LQLIN00072
     RDKit          3D

288290  0  0  1  0  0  0  0  0999 V2000
    1.0736   -9.9360    9.4351 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.9824   -7.5493    6.0828 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.2237   -6.0074    4.5657 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.1054   -1.4706    3.8140 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.3000   -1.2650    3.6095 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.8760   -3.9560    5.5536 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.8704   -5.7501    5.4179 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.6055   -9.0491    2.1981 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.7212   -8.6134    8.9277 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.1801   -7.7658    7.4578 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.6372   -4.6196    4.1144 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.9664   -2.5112    3.6943 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.6406   -1.9213    3.1677 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.0581   -3.0046    4.3252 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.4551   -6.4317    4.0690 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.4695   -7.8135    2.6310 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.3373   -2.1338    9.4302 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.8335   -6.5744    4.5036 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.2678   -8.6885    1.4035 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.5913   -9.7077    2.0471 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.3743   -5.3952    5.5616 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.1527   -7.9078    1.9705 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.5528   -3.3294    8.4562 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.0949   -4.7735    6.8121 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.3761   -6.9386    4.6907 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.7841   -7.3418    3.2652 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.9949   -8.9956    2.2355 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.1468   -9.2650    2.4903 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.4709    6.9521    1.7004 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.6565    7.1730    1.5844 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.2121    5.8174    0.8098 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1491   -0.4955   10.3427 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.7200    0.6639   12.0214 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.0906   -0.7910   12.3156 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.2310   -3.4947    8.7029 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.5526   -4.5976    6.7841 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.9348    0.4735   10.3339 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.9541    1.0298   11.1354 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.3988   -2.1002   11.8757 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.1143   -3.4639   10.2566 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.6971   -5.8324    5.7901 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.7901   -6.2106    3.6714 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.7372    7.0942    0.0988 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0704   -6.2687    0.8800 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.8258   -5.4918    2.3007 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.9073   -7.6139   -2.1459 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.2642   -7.9345   -0.2407 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.4427   -4.7401    0.7404 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.7200    5.7191   -1.6367 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.6464    5.3357   -3.1438 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.4561   -7.7423   -2.3429 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.4489   -8.1299   -1.5206 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.0236   -5.2073    0.4799 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.9450   -4.5834    0.2986 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.9414   -6.4041   -2.1929 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.2509   -1.5421   -6.0750 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.0527   -2.2637   -6.5833 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.7329   -2.9942   -1.8686 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8487   -5.1735   -2.4380 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.8216    2.7067   -5.7528 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.8251    4.0817   -5.0074 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.3389   -0.8185   -6.4961 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.5990   -0.6046   -7.3969 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.8249   -4.6584   -5.7617 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.7449   -1.2878   -3.4537 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.1504   -0.4961   -1.8823 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.8877   -3.5276   -6.3689 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.8466    1.0392   -6.9051 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.6409    0.2611   -7.5468 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.6021   -5.3411   -4.6846 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.4122   -2.4707   -5.7949 O   0  0  0  0  0  1  0  0  0  0  0  0
    4.6247   -0.5970   -4.4182 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3732    7.7400   -7.3155 C   0  0  0  0  0  1  0  0  0  0  0  0
    2.2422    9.2791   -8.1733 C   0  0  0  0  0  1  0  0  0  0  0  0
    5.8421   -4.9250   -3.8621 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.9140    7.7172   -7.6915 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.3884   -1.2311   -5.4632 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6410    0.8500   -4.2551 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.6124   -3.5864   -2.3120 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.4642   -0.7047    0.1817 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.1873    0.4432    1.0089 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.8818    4.0163   -5.5974 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3415    1.7584   -5.0887 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6995    6.5805   -8.2236 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.1647    5.4909   -9.6845 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1319   -0.2796   -6.2003 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.0727    2.8429   -9.9615 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.6917    2.1342   -8.1804 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.6436    6.0130   -5.2630 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.2575    7.3961   -3.7058 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.0512    8.5986    0.5869 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.1491    8.3172    2.4394 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.6563    6.1508    4.2618 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.6402    4.2945    3.1944 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2291   -2.5189   -1.2106 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.1209    1.1232   -6.0328 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.1496    5.2948   -5.9980 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.1587    6.5787   -7.7155 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6858    4.1694  -10.0192 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.4449    3.0195   -6.9291 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.7639    4.7657   -5.5572 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.3306    7.6133   -2.1722 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.3120    8.1851   -0.2455 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.5150    7.5588    3.7323 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.2154    6.6945    4.6272 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.7959    1.5056    1.8440 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8000    3.2519    3.2031 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.0195    6.4278   -5.0615 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.2165    2.9235    4.5654 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.7165    7.5115   -4.0158 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.2744    3.1327    6.1938 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.6844    8.0804   -3.0264 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.4586    3.7397    7.5048 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7297    7.1260   -2.1998 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9707    2.2009    8.7974 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.1192    1.0725    9.1929 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1554  -10.8995   -3.4216 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.9094    0.3571    8.7974 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.4912  -10.0784   -4.7010 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.3376  -11.2771   -1.2213 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.0350  -11.0050    0.1790 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.5537   -0.3464   11.4178 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.6566    0.5312    7.8645 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3746    4.9860    2.4329 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6276    6.9991  -11.1500 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.7639   -0.6619    9.8346 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.6332    3.5208    4.3180 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.4062    7.9227  -11.4215 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.2809   -8.1150   -5.7177 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.9858    1.4716    6.7499 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.0701  -10.8685    2.4249 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.3982    2.5262    5.5554 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.3373   -2.1559    9.7242 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.1976    8.4207  -11.6488 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.7477    0.5126    7.8284 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.8327   -6.6283   -5.7122 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.5107  -10.8961    3.8965 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.4662    6.2459  -10.1947 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.6091    6.3665   -9.0638 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.3764    8.2742  -11.5566 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.9548   -0.2828    8.5059 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1372   -4.6937   -4.8246 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.8914   -3.6728   -3.6360 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.1591   -9.8578    5.8781 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.9841   -8.7168    6.9253 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.7259    4.9351   -7.9969 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.1600    7.0299  -11.0330 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.8757    5.6742  -10.6740 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.0227   -2.3137   -2.5059 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.9805   -0.5787    7.5097 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1205   -6.5904    7.5570 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.8885   -1.5100    8.0069 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.5751    3.4125   -8.0933 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.5549    3.9514   -9.4931 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.4965   -1.9140   -2.3693 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.0041   -0.4419    6.1179 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.4934   -5.0927    7.3080 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.8218   -2.1430    7.1631 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.9469    2.3384   -8.8766 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.4642    2.6841   -9.2924 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.3791    0.3046    2.0431 C   0  0  0  0  0  1  0  0  0  0  0  0
   -3.6690    3.6380   -7.9939 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.3207   -1.6129   -1.2375 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.9090   -1.1249    5.2804 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2425   -1.2021   -0.0541 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.9955   -1.9312    5.7777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5642   -3.5468    5.7674 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.5772   -3.1909    4.2604 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.5711    1.6893   -9.4350 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.9460    2.5470   -6.0320 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.5064   -1.0697    3.9054 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.6313    1.4768   -5.0893 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.5139    0.5170    0.3183 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.0023   -2.3966    5.1248 O   0  0  0  0  0  1  0  0  0  0  0  0
   -2.9204   -1.8760    2.1500 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2118    0.4655   -8.5855 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.9978    1.7567   -3.5374 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.9397    1.6618   -0.6251 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.3816    0.5102   -6.5913 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.9404    1.4336   -5.4077 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.9673    2.2245   -2.4148 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.1583    5.4359   -4.0734 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.6469    2.1063   -3.6909 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.7949    6.4243   -5.0782 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.7687    4.0513   -2.8755 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.6483    2.0945   -2.8410 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.5402    3.1758   -2.5087 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.5602   -7.5973    8.6132 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0279   -3.4910    3.7225 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8551   -2.4847    3.0868 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1557   -6.6977    2.7838 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7437  -11.3568    9.9016 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5946   -7.2456    4.9309 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1837   -0.7258    4.0901 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3610   -4.9339    6.3368 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8317  -10.0084    1.7050 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0677   -7.1207    4.5488 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9418   -4.4305    7.7965 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0384   -8.8891    3.0732 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2246   -1.2720   10.4520 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0908   -6.0865    4.4411 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5048   -8.4354    0.9252 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1224    4.6660    1.2140 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9539    1.3793   10.3236 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1531   -3.3019   11.5832 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7047   -6.7898    4.8655 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6824    0.3238   12.7779 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4185   -3.4211    7.3700 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8064    6.2058   -0.3670 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3523    7.9618   -0.5831 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7328   -8.0901   -2.6456 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1912   -4.3003   -0.0355 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4286   -7.6359   -2.0953 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8109   -7.3821    0.8395 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8215   -4.8018    1.1546 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7516   -4.0435   -2.7117 N   0  0  0  0  0  2  0  0  0  0  0  0
   -8.7915    5.3126   -4.4851 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5840   -3.1940   -0.6493 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3694   -1.0126   -5.5749 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1375   -2.7929   -7.1601 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9822    1.5330   -6.3907 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8736   -1.7097   -2.4339 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6561   -0.4110   -8.1961 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5220   -5.7202   -5.3622 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9447   -4.5136   -3.2151 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1064    3.9987   -5.8032 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3784    6.4215   -9.9153 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5644    3.9634    2.6653 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5852    5.3872   -7.2866 N   0  0  0  0  0  2  0  0  0  0  0  0
    6.9744    2.5384    2.0490 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.0441    3.7656   -5.9261 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4498    7.8472   -0.8671 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9488    7.0236    4.8826 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3433    5.5627   -9.0743 N   0  0  0  0  0  2  0  0  0  0  0  0
    5.1422    3.1109   -4.9702 N   0  0  0  0  0  2  0  0  0  0  0  0
   -0.6593    1.7621   -9.4681 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3788    7.1029   -5.0054 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9364    9.0782    1.3778 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8974    5.4416    3.9089 N   0  0  0  0  0  2  0  0  0  0  0  0
    5.7167   -1.7600   -0.2405 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8675    7.5966   -7.9486 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0028    1.3724    2.1028 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4279    8.2506   -2.2824 N   0  0  0  0  0  2  0  0  0  0  0  0
    8.3638    4.5918    7.5572 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7376    3.4900    8.6167 N   0  0  0  0  0  2  0  0  0  0  0  0
    5.4813    0.4320   10.1820 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4913    7.0863   -2.0682 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2769    5.7867   -2.4179 N   0  0  0  0  0  1  0  0  0  0  0  0
    4.1380    0.8442    8.3530 N   0  0  0  0  0  2  0  0  0  0  0  0
   -1.8113  -11.6783   -2.3737 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3515    4.8471    0.9468 N   0  0  0  0  0  1  0  0  0  0  0  0
    1.8556    0.7090    6.6544 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3128    5.6704    2.8493 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7670   -9.3689   -5.8076 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4186    4.2808    3.0612 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.7851  -10.8252    1.2881 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4591    0.2593    8.4424 N   0  0  0  0  0  2  0  0  0  0  0  0
    5.5850    6.0885  -11.1752 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4740    8.8700  -11.6762 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4463   -5.3615   -5.9569 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1989  -11.0073    5.1854 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7056    8.2130  -11.5092 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1765    0.2352    8.2256 N   0  0  0  0  0  2  0  0  0  0  0  0
    8.6132    6.2707   -8.1708 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7919   -1.2221    9.2805 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7297   -2.7245   -2.7251 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7654   -7.8275    7.9146 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1814    2.1801   -8.4130 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4078    4.4484  -10.7450 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8122   -1.7279   -2.4346 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6196   -3.7887    7.0830 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6036    3.6904   -6.6391 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1940    2.8484   -9.6998 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8285   -0.9479    2.7398 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1152   -0.6856    0.8196 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3880   -2.9113    2.8350 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.7351   -0.2984   -7.5999 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3425    0.7659   -4.1588 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7078   -1.8244    0.9182 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9400    2.5915   -1.6051 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6390    7.3842   -5.9608 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7917    2.2707   -4.3567 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9924    4.5734   -3.0501 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6855    2.2571   -1.9900 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5659  -11.9611   10.6904 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3515  -11.9461    9.5006 O   0  0  0  0  0  1  0  0  0  0  0  0
   -6.6244    8.6395   -5.6738 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3963    6.8723   -6.8593 O   0  0  0  0  0  1  0  0  0  0  0  0
  1  9  1  0
  1192  1  0
  2 10  1  0
  2193  1  0
  3 11  1  0
  4 12  1  0
  4194  1  0
  5 13  1  0
  5194  1  0
  6 14  1  0
  6195  1  0
  7 15  1  0
  7195  1  0
  8 16  1  0
  8196  1  0
  9188  1  0
 10188  1  0
 11189  1  0
 12189  1  0
 13190  1  0
 14190  1  0
 15191  1  0
 16191  1  0
 17 23  1  0
 17200  1  0
 18 25  1  0
 18201  1  0
 19 27  1  0
 20 28  1  0
 20196  1  0
 21 24  1  0
 21201  1  0
 22 26  1  0
 22202  1  0
 23198  1  0
 24198  1  0
 25197  1  0
 26197  1  0
 27199  1  0
 28199  1  0
 29 30  2  0
 29 31  1  0
 30 43  1  0
 31203  2  0
 31209  1  0
 32 37  1  0
 32200  1  0
 33 38  1  0
 33207  1  0
 34 39  1  0
 34207  1  0
 35 40  1  0
 35208  1  0
 36 41  1  0
 37204  1  0
 38204  1  0
 39205  1  0
 40205  1  0
 41206  1  0
 42 45  1  0
 42206  1  0
 43209  1  0
 43210  2  0
 44 53  1  0
 46 51  1  0
 46213  1  0
 47 52  1  0
 47214  1  0
 48 54  1  0
 48215  1  0
 49 50  1  0
 49209  1  0
 50217  1  0
 51211  1  0
 52211  1  0
 53212  1  0
 54212  1  0
 56 57  1  0
 56219  1  0
 57220  1  0
 58218  2  0
 58222  1  0
 58216  1  0
 59216  1  0
 59 55  1  0
 60221  1  0
 61217  1  0
 61 60  1  0
 62 63  1  0
 62219  1  0
 63223  1  0
 64 67  1  0
 64224  1  0
 65 72  1  0
 65222  1  0
 66222  1  0
 67220  1  0
 68 69  1  0
 68221  1  0
 69223  1  0
 70 75  1  0
 70224  1  0
 71 77  1  0
 72 77  2  0
 72 78  1  0
 73 76  1  0
 74 76  1  0
 75225  1  0
 77 86  1  0
 78 83  2  0
 79 95  1  0
 79225  1  0
 80 81  1  0
 80240  1  0
 81106  1  0
 82 97  1  0
 82226  2  0
 82235  1  0
 83 96  1  0
 83235  1  0
 84 98  1  0
 84234  1  0
 84 76  1  0
 85 99  1  0
 85227  2  0
 85234  1  0
 86 96  2  0
 87 99  1  0
 87236  1  0
 88100  1  0
 88236  1  0
 89101  1  0
 89237  1  0
 90102  1  0
 90237  1  0
 91103  1  0
 91238  1  0
 92104  1  0
 92238  1  0
 93105  1  0
 93239  1  0
 94107  1  0
 94228  2  0
 95240  1  0
 97108  1  0
 97229  1  0
 98229  1  0
 98241  2  0
100231  1  0
101231  1  0
102232  1  0
103232  1  0
104233  1  0
105233  1  0
106230  1  0
106242  2  0
107109  1  0
107230  1  0
108110  1  0
109111  1  0
110112  1  0
111113  1  0
112243  1  0
113244  2  0
113245  1  0
114243  1  0
114247  2  0
114248  1  0
115116  1  0
115245  1  0
116246  2  0
116249  1  0
117119  1  0
117250  1  0
118123  1  0
118126  1  0
118249  1  0
119254  1  0
120121  1  0
120250  1  0
121256  1  0
122126  1  0
123252  2  0
123257  1  0
124251  1  0
124253  2  0
124255  1  0
125128  1  0
125258  1  0
126133  1  0
127132  1  0
127255  1  0
128259  1  0
129136  1  0
130132  1  0
131137  1  0
131256  1  0
134140  1  0
134259  1  0
135130  1  0
135141  1  0
135257  1  0
136260  1  0
137261  1  0
138258  1  0
138139  1  0
139264  1  0
140262  1  0
141263  1  0
141265  2  0
142143  1  0
142260  1  0
143266  1  0
144145  1  0
144261  1  0
145267  1  0
146153  1  0
146264  1  0
147148  1  0
147262  1  0
148269  1  0
149155  1  0
150156  1  0
150263  1  0
150152  2  0
151157  1  0
151267  1  0
152158  1  0
153268  1  0
154162  1  0
154269  1  0
155270  1  0
156164  2  0
157271  1  0
158166  2  0
159160  1  0
160273  1  0
161274  1  0
162272  1  0
163165  1  0
163270  1  0
164166  1  0
164171  1  0
165275  1  0
166174  1  0
167168  1  0
167271  1  0
168276  1  0
169176  1  0
169273  1  0
170272  1  0
170172  1  0
171274  1  0
172278  1  0
173178  1  0
173275  1  0
175274  1  0
175279  2  0
176277  1  0
177181  1  0
177278  1  0
178280  1  0
179180  1  0
179277  1  0
180282  1  0
181280  1  0
182184  1  0
182283  1  0
183186  1  0
183282  1  0
184281  1  0
185187  1  0
185283  1  0
186284  1  0
187284  1  0
192285  2  0
192286  1  0
193  3  1  0
202 19  1  0
208 36  1  0
213 55  1  0
214 44  1  0
215 45  1  0
239 94  1  0
254129  1  0
266149  1  0
268159  1  0
276175  1  0
281287  2  0
281288  1  0
M  RAD  8   1   3   2   3   3   3   4   3   5   3   6   3   7   3   8   3
M  RAD  8   9   3  10   3  11   3  12   3  13   3  14   3  15   3  16   3
M  RAD  8  17   3  18   3  19   3  20   3  21   3  22   3  23   3  24   3
M  RAD  8  25   3  26   3  27   3  28   3  29   2  30   2  32   3  33   3
M  RAD  8  34   3  35   3  36   3  37   3  38   3  39   3  40   3  41   3
M  RAD  8  42   3  44   3  45   3  46   3  47   3  48   3  49   3  50   3
M  RAD  8  51   3  52   3  53   3  54   3  55   3  56   3  57   3  59   3
M  RAD  8  60   3  61   3  62   3  63   3  64   3  65   3  66   2  67   3
M  RAD  8  68   3  69   3  70   3  71   2  73   2  74   2  75   3  76   2
M  RAD  8  78   2  79   3  80   3  81   3  84   2  86   2  87   3  88   3
M  RAD  8  89   3  90   3  91   3  92   3  93   3  95   3  96   2  97   2
M  RAD  8  99   3 100   3 101   3 102   3 103   3 104   3 105   3 107   2
M  RAD  8 108   3 109   3 110   3 111   3 112   3 115   3 117   3 118   2
M  RAD  8 119   3 120   3 121   3 122   2 125   3 126   2 127   3 128   3
M  RAD  8 129   3 130   3 131   3 132   3 133   2 134   3 135   2 136   3
M  RAD  8 137   3 138   3 139   3 140   3 142   3 143   3 144   3 145   3
M  RAD  8 146   3 147   3 148   3 149   3 151   3 152   2 153   3 154   3
M  RAD  8 155   3 156   2 157   3 158   2 159   3 160   3 161   2 162   3
M  RAD  8 163   3 165   3 167   3 168   3 169   3 170   3 171   3 172   3
M  RAD  8 173   3 174   2 176   3 177   3 178   3 179   3 180   3 181   3
M  RAD  8 182   3 183   3 184   3 185   3 186   3 187   3 216   2 229   2
M  RAD  8 230   2 234   2 235   2 239   2 243   2 245   2 248   3 249   2
M  RAD  7 251   3 255   2 257   2 263   2 276   2 286   2 288   2
M  END
$$$$
