cxy0178
     RDKit          3D

261284  0  0  1  0  0  0  0  0999 V2000
   -3.8651   14.4071   -3.8376 C   0  0  0  0  0  1  0  0  0  0  0  0
   -4.2450   12.7163   -3.6265 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1090    7.8848    5.3458 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.1854    9.9861   -2.1593 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.4818    6.5049    6.1471 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.8441    8.0492    3.9334 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.0904   11.1946   -1.9613 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.8362   -1.7211    8.3753 C   0  0  0  0  0  1  0  0  0  0  0  0
   -4.3363    8.9273   -1.2172 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.9095   -0.8922    7.2815 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1291    5.1592    5.4125 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.7120    6.9242    3.2574 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.1421    8.3114   -0.1052 C   0  0  1  0  0  0  0  0  0  0  0  0
   -6.2514   10.9107   -0.8185 C   0  0  2  0  0  0  0  0  0  0  0  0
   -8.3694   13.5630   -0.3820 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.9976    7.3187    2.0557 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.0407   12.4909   -0.1559 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.0388    0.8483    5.8677 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.3829   13.7332   -1.4949 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.3685   -0.5077    6.4676 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.8697    2.2205    6.1652 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.5118    7.3535   -1.0512 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9826   -2.3258   -1.9639 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.6191   -1.0490    1.2933 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.5359   -2.2507    0.8585 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.9618   -0.8914    6.6304 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.0773    1.6753    7.1311 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.8207   -2.5101   -0.5200 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.2329    0.3909    0.5619 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.9397    3.6217   -0.8986 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.2720    1.9230    8.7039 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.8384    5.2849   -0.8126 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.0541   -4.1320    7.7091 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.3141    1.3633   -0.3226 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.4095   -4.9842    7.9056 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.7856   -3.3604    6.2572 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.0146   -3.8129    5.1073 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.6534   -4.6656    7.1710 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.0150   -5.3757    7.6734 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.2307   -8.8933  -12.8265 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.1405   -7.2270   -5.5496 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.8202   -9.6264  -11.4978 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.3412   -7.3718  -12.7697 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.5507   -8.5380   -5.4116 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2813   -5.3996    2.3768 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.2271   -4.7220    1.3255 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2919   -6.3902    1.5596 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.2891   -2.8563   -7.3506 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.9054   -6.5830  -11.4662 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.8154   -8.8371  -10.0453 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.6673  -10.4474   -6.6387 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.9468   -1.7127   -6.2661 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3290   -5.1858  -11.6934 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.5114   -5.9152    0.3143 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.2665  -10.0414   -5.1424 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.8637   -9.6679   -7.2223 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.6559   -4.2726    0.1275 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1641   -6.6146   -0.4098 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.1326   -2.9088   -3.1256 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.2681   -9.7203   -4.0923 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.0662   -9.7559   -6.1936 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.4197   -1.6814   -3.9204 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.0879   -2.4892   -2.0897 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.5070    1.1138   -2.7369 C   0  0  0  0  0  1  0  0  0  0  0  0
   -5.2963  -10.6707   -6.5696 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.0779    1.7851   -4.0395 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7853   -0.2346   -3.3006 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.0148   -1.2970   -2.5877 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.3961   -1.6063   -3.3504 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.9364   -8.0716   -1.0108 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.1249   -9.5213   -1.4998 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.4834    2.2442   -3.5995 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.0309    2.6945   -3.3745 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.3953    1.9240   -2.2828 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.0558  -10.6072   -0.9051 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.0031    2.7120   -0.8466 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.7038    3.5256   -2.2732 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.7659   -8.6391   -1.1679 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.4365  -10.1680   -0.9479 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.0031    3.0671    0.6770 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.2131   -8.1851   -1.5458 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.0457    4.3367    4.0060 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.5582    4.0982    5.5348 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.8069    3.2726    3.3050 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.4415    2.7370    6.0923 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.6237    1.6473    5.2196 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.3554    0.1602    5.0867 C   0  0  0  0  0  1  0  0  0  0  0  0
   -3.8051   12.3401   -4.7299 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1226    8.9329    6.0309 O   0  0  0  0  0  1  0  0  0  0  0  0
   -3.6585    9.8633   -3.3068 O   0  0  0  0  0  1  0  0  0  0  0  0
   -0.0253    6.3916    7.3381 O   0  0  0  0  0  1  0  0  0  0  0  0
   -0.6548    9.1162    3.2869 O   0  0  0  0  0  1  0  0  0  0  0  0
   -5.1522   12.3717   -2.7244 N   0  0  0  0  0  2  0  0  0  0  0  0
   -8.4773   14.5825    0.4491 O   0  0  0  0  0  1  0  0  0  0  0  0
    1.6559    0.0760    7.0112 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1146    0.7855    4.9777 O   0  0  0  0  0  1  0  0  0  0  0  0
   -4.2845    7.4280    1.2064 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6167   14.2086   -2.2442 O   0  0  0  0  0  1  0  0  0  0  0  0
   -1.5677    5.4464    3.9388 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9368    9.7073    0.3618 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3911   -1.2671    7.1662 N   0  0  0  0  0  2  0  0  0  0  0  0
   -1.2678    3.7267    6.3000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9964   10.3627   -1.4106 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2866   13.0629    0.7860 O   0  0  0  0  0  1  0  0  0  0  0  0
   -4.0302   -4.6180    8.2760 O   0  0  0  0  0  1  0  0  0  0  0  0
   -6.8214    7.6977   -2.2377 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4963   -3.0437    0.5021 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4304   -0.0498    1.5752 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5024   -5.8375    8.9273 O   0  0  0  0  0  1  0  0  0  0  0  0
   -3.6475   -2.1731    5.8507 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7551    0.4432    6.6834 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9342    2.3181   -1.1582 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3474    2.0331   10.2229 O   0  0  0  0  0  1  0  0  0  0  0  0
   -3.4533   -9.5842  -13.9045 O   0  0  0  0  0  1  0  0  0  0  0  0
  -10.0927   -6.1309    8.5143 O   0  0  0  0  0  1  0  0  0  0  0  0
   -7.4137   -4.0646    5.8122 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5917   -4.4585    3.6030 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1120  -10.6832  -11.6617 O   0  0  0  0  0  1  0  0  0  0  0  0
   -1.7238  -11.7263   -6.7878 O   0  0  0  0  0  1  0  0  0  0  0  0
   -3.5372   -6.7475  -13.8740 O   0  0  0  0  0  1  0  0  0  0  0  0
    1.6930   -8.3966   -5.9655 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5283   -4.8047    1.7024 O   0  0  0  0  0  1  0  0  0  0  0  0
   -5.6032   -7.6192    1.5948 O   0  0  0  0  0  1  0  0  0  0  0  0
   -6.4790   -0.7211   -6.8528 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9050   -3.8792  -12.2662 O   0  0  0  0  0  1  0  0  0  0  0  0
    0.0706   -9.7120   -4.8911 N   0  0  0  0  0  2  0  0  0  0  0  0
   -6.2989   -4.0181   -3.6800 O   0  0  0  0  0  1  0  0  0  0  0  0
   -3.2089   -9.7416   -8.7824 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9628   -7.3094  -10.1373 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2090   -4.7209   -0.3073 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0935   -1.8173   -5.2170 N   0  0  0  0  0  2  0  0  0  0  0  0
   -7.4029   -3.2147   -0.7697 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9760    1.5403   -4.8171 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0212   -6.9828   -1.1939 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1074   -9.9134   -2.5706 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6186   -9.8799   -4.6825 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0281    2.6748   -4.6688 O   0  0  0  0  0  1  0  0  0  0  0  0
   -6.3603  -11.6662   -6.8002 O   0  0  0  0  0  1  0  0  0  0  0  0
   -1.0873    2.3595   -4.3638 N   0  0  0  0  0  2  0  0  0  0  0  0
   -7.2389   -0.1564   -3.1372 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9099    0.4282   -2.2288 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6066   -7.6640   -1.0570 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4499  -11.5315   -0.0656 O   0  0  0  0  0  1  0  0  0  0  0  0
  -10.7183   -1.9218   -4.0501 O   0  0  0  0  0  1  0  0  0  0  0  0
   -9.0048    4.6567    3.2151 O   0  0  0  0  0  1  0  0  0  0  0  0
   -2.6562    3.4349   -1.0062 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8011    5.0974    6.2986 O   0  0  0  0  0  1  0  0  0  0  0  0
    4.6336   -7.9858   -1.9709 O   0  0  0  0  0  1  0  0  0  0  0  0
    2.3283  -10.9992   -0.4777 O   0  0  0  0  0  1  0  0  0  0  0  0
   -5.8320    3.7095    1.9366 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0931    2.3421    7.1626 O   0  0  0  0  0  1  0  0  0  0  0  0
   -6.8768    1.9824    3.9580 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5386    6.7463   -0.3576 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.7107   -1.8330   -5.2999 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9789   -1.7909   -3.8863 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3138   -1.8922   -1.7872 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.3040   -1.3340   -7.6411 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.4457   -1.7368   -0.9595 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.2850   -1.6168   -3.1779 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2654   -1.2060   -6.6059 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4041   -0.8177   -8.9723 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.5659   -1.2202   -1.5432 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.6326   -0.3861   -9.3379 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.5199   -1.2181   -3.7468 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4464   -0.5184   -7.0086 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6466   -1.0302   -2.9297 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.6084   -0.3019   -8.3598 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.5659   -0.7540   -5.0554 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.2503    2.5991   -1.0413 C   0  0  0  0  0  1  0  0  0  0  0  0
    4.5390    0.9360   -6.7157 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6075    3.2003    0.3962 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.9623    3.9269   -7.6527 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.8026    8.3956   -5.7176 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6540    8.4586   -3.2605 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.1712    5.4157   -0.2650 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5327   -0.5514    2.3294 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.1103    7.8831   -1.8139 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1218    2.3386   -7.1735 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.9617    5.2968   -8.2536 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4304    7.4401   -6.7491 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.7960    6.1927   -0.1129 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.3505    2.1616    1.3423 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9287   -0.1003    1.0672 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5269   -1.8570    2.7512 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.8188    5.8444    1.0021 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.1370   -1.1461    0.1249 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.7873   -2.8845    1.7956 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0049   -2.5089    0.4856 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.8726   -5.4868    2.3805 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6545    4.4006    1.5383 C   0  0  0  0  0  1  0  0  0  0  0  0
    3.9041    6.8726    2.3445 C   0  0  0  0  0  1  0  0  0  0  0  0
    7.6239   -4.2005    2.2088 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.3476   -2.1077    3.1858 C   0  0  0  0  0  3  0  0  0  0  0  0
    9.8981   -5.8341    5.8070 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.2101   -5.9067    5.4782 C   0  0  0  0  0  3  0  0  0  0  0  0
   10.6536    0.2774    4.9015 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.6665   -5.7665    3.2091 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.6042   -0.9155    3.3835 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3393   -2.7677    1.9760 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6371   -6.2357    6.6466 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.5457   -5.7727    6.8630 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2229   -5.1949    4.8611 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4444    1.0276    4.4346 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.9586    2.1557    5.2579 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.7063   -4.5386    3.2977 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.0106   -0.3811    2.2834 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4563   -2.4522    0.9592 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0357   -5.4233    9.7519 C   0  0  0  0  0  1  0  0  0  0  0  0
    5.9134   -4.8771    7.6993 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3904   -4.4981    5.7805 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4557   -4.3586    2.4753 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.9365   -1.1884    1.0643 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.8896   -4.2073    7.1483 C   0  0  0  0  0  3  0  0  0  0  0  0
    9.0254    3.4079    4.5838 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9249    1.1014    2.3008 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8870   -4.6058    5.8220 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3447   -3.8970    3.2565 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8654    3.0590    3.4723 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.3606   -2.7135    2.9963 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.8785   -4.1237    4.5426 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.2724   -3.8269   -0.7017 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.0583   -4.0809    2.9975 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.5731   -3.3192   -4.2969 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2854   -2.3463   -3.3720 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0117   -3.0021   -5.4755 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5924   -0.0824   -6.2360 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7271    8.9875   -6.1348 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0564    5.6954   -1.1190 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2773    7.1816   -1.0487 N   0  0  0  0  0  2  0  0  0  0  0  0
    8.0327    1.1985    0.6696 N   0  0  0  0  0  2  0  0  0  0  0  0
    4.9016    6.2396   -7.9054 N   0  0  0  0  0  2  0  0  0  0  0  0
    5.7634    0.7089   -6.9083 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5998    8.9151   -4.7777 N   0  0  0  0  0  2  0  0  0  0  0  0
    6.4777    4.5446    0.7295 N   0  0  0  0  0  2  0  0  0  0  0  0
    3.2280    5.4064   -9.2894 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1914    8.3257   -1.5015 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5191    2.3924    2.5770 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2062   -5.3282    2.7579 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7199   -5.6660    1.1385 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4739   -6.8805    3.9507 O   0  0  0  0  0  1  0  0  0  0  0  0
   11.5450   -0.4337    4.7993 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.2939   -3.7192    1.8727 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9148   -5.4303    3.4392 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5354   -6.5792    7.2574 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5897    0.3189    4.2574 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2860   -3.6113    3.1108 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0705    1.7049    3.2084 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.1375   -3.2570   -0.0884 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1804   -4.5869    8.9837 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1850   -4.4631    4.7197 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.9381    1.6931    1.8711 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4594   -4.9463    6.9353 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6565    4.4481   -2.1985 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.1416    4.7271   -3.2333 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1955    5.5678   -4.5015 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.3891    4.6059   -3.3246 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3818    4.7086    5.2194 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.0060    4.4007    4.5897 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.1550   -5.6294    4.9770 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.3612   -5.3084    4.0045 C   0  0  0  0  0  2  0  0  0  0  0  0
   13.0164   -4.5965    2.8310 C   0  0  0  0  0  2  0  0  0  0  0  0
  1  2  1  0
  2 88  2  0
  2 93  1  0
  3  5  1  0
  3  6  1  0
  3 89  1  0
  4  7  1  0
  4  9  1  0
  4 90  1  0
  5 11  1  0
  5 91  1  0
  6 12  1  0
  6 92  1  0
  7 14  1  0
  7 93  1  0
  8 10  1  0
  9 13  1  0
 10 95  2  0
 10101  1  0
 11 99  1  0
 11102  1  0
 12 16  1  0
 12 99  1  0
 13 22  1  0
 13 97  1  1
 13100  1  0
 14 17  1  0
 14100  1  0
 14103  1  6
 15 17  1  0
 15 19  1  0
 15 94  1  0
 16 97  1  0
 17104  1  0
 18 20  1  0
 18 21  1  0
 18 96  1  0
 19 98  1  0
 20 26  1  0
 20101  1  0
 21 27  1  0
 21102  1  0
 22106  2  0
 22153  1  0
 23 28  1  0
 24 25  1  0
 24108  1  0
 25107  1  0
 26110  1  0
 26111  1  0
 27 31  1  0
 27111  1  0
 28107  1  0
 29 34  1  0
 29108  1  0
 30 32  1  0
 30112  1  0
 31113  1  0
 33 35  1  0
 33 36  1  0
 33105  1  0
 34112  1  0
 35 38  1  0
 35109  1  0
 36 37  1  0
 36110  1  0
 37116  1  0
 37117  1  0
 38 39  1  0
 38116  1  0
 39115  1  0
 40 42  1  0
 40 43  1  0
 40114  1  0
 41 44  1  0
 42 50  1  0
 42118  1  0
 43 49  1  0
 43120  1  0
 44121  2  0
 44126  1  0
 45 46  1  0
 45 47  1  0
 45117  1  0
 46 57  2  0
 46122  1  0
 47 54  1  0
 47123  1  0
 48 52  1  0
 49 53  1  0
 49129  1  0
 50128  1  0
 50129  1  0
 51 55  1  0
 51 56  1  0
 51119  1  0
 52124  2  0
 52131  1  0
 53125  1  0
 54 58  1  0
 54130  1  0
 55 60  1  0
 55126  1  0
 56 61  1  0
 56128  1  0
 57130  1  0
 57132  1  0
 58134  1  0
 59 62  1  0
 59 63  1  0
 59127  1  0
 60135  1  0
 60136  1  0
 61 65  1  0
 61136  1  0
 62 67  1  0
 62131  1  0
 63 68  1  0
 63132  1  0
 64 66  1  0
 65138  1  0
 66133  2  0
 66139  1  0
 67140  1  0
 67141  1  0
 68 69  1  0
 68140  1  0
 69144  1  0
 70 71  1  0
 70134  1  0
 70142  1  0
 71 75  1  0
 71135  1  0
 72 73  1  0
 72 74  1  0
 72137  1  0
 73 77  1  0
 73139  1  0
 74 76  1  0
 74141  1  0
 75 79  1  0
 75143  1  0
 76 80  1  0
 76146  1  0
 77146  1  0
 77253  1  0
 78 79  1  0
 78 81  1  0
 78142  1  0
 79149  1  0
 80150  1  0
 81148  1  0
 82 83  1  0
 82 84  1  0
 82145  1  0
 83 85  1  0
 83147  1  0
 84150  1  0
 84152  1  0
 85 86  1  0
 85151  1  0
 86 87  1  0
 86152  1  0
153 32  1  0
154155  2  0
154160  1  0
154225  1  0
155159  1  0
155224  1  0
156158  2  0
156159  1  0
157160  2  0
157161  1  0
158162  1  0
159164  2  0
160165  1  0
161163  2  0
162166  2  0
163167  1  0
164166  1  0
164168  1  0
165167  2  0
165226  1  0
168226  1  0
170178  1  0
170226  1  0
170232  2  0
171169  1  0
171182  1  0
171234  1  0
172178  1  0
172179  1  0
173180  1  0
173227  2  0
173233  1  0
174177  1  0
174233  1  0
175228  2  0
175234  1  0
176183  2  0
176184  1  0
177229  1  0
177236  2  0
179231  1  0
179235  2  0
180231  1  0
181175  1  0
181185  1  0
181229  1  0
182230  1  0
182237  2  0
183186  1  0
183230  1  0
184187  2  0
185190  1  0
185191  1  0
186188  2  0
187188  1  0
187192  1  0
189238  1  0
189239  2  0
189243  1  0
192238  1  0
193198  2  0
193199  1  0
194200  1  0
194259  1  0
195201  2  0
195202  1  0
196203  1  0
196241  2  0
197205  1  0
197240  1  0
197243  1  0
198206  1  0
198241  1  0
199207  2  0
199242  1  0
200244  1  0
201209  1  0
201244  1  0
202210  2  0
202243  1  0
203204  1  0
203245  1  6
203247  1  0
204214  1  0
205211  1  0
205246  1  6
205250  1  0
206212  2  0
206215  1  0
207212  1  0
207248  1  0
208249  1  0
209213  2  0
209249  1  0
210213  1  0
210216  1  0
211217  1  0
214218  1  0
214257  1  0
215247  1  0
215251  2  0
216250  1  0
216252  2  0
217219  1  0
217220  1  0
217222  1  0
218247  1  0
219222  1  0
220250  1  0
221248  1  0
223224  1  0
223225  2  0
224 23  1  0
253254  1  0
254255  1  0
256254  2  0
257258  1  0
258214  1  0
259260  1  0
260261  1  0
261242  1  0
M  RAD  8   1   2   3   2   4   2   5   2   6   2   7   2   8   2   9   3
M  RAD  8  11   2  12   2  15   2  16   3  17   2  18   2  19   3  20   2
M  RAD  8  21   2  23   3  24   3  25   3  26   2  27   2  28   3  29   3
M  RAD  8  30   3  31   3  32   3  33   2  34   3  35   2  36   2  37   2
M  RAD  8  38   2  39   3  40   2  41   2  42   2  43   2  45   2  47   2
M  RAD  8  48   2  49   2  50   2  51   2  53   3  54   2  55   2  56   2
M  RAD  8  58   3  59   2  60   2  61   2  62   2  63   2  64   2  65   3
M  RAD  8  67   2  68   2  69   3  70   2  71   2  72   2  73   2  74   2
M  RAD  8  75   2  76   2  77   2  78   2  79   2  80   3  81   3  82   2
M  RAD  8  83   2  84   2  85   2  86   2  87   2  89   2  90   2  91   2
M  RAD  8  92   2  93   2  94   2  96   2  98   2 101   2 104   2 105   2
M  RAD  8 109   2 113   2 114   2 115   2 118   2 119   2 120   2 122   2
M  RAD  8 123   2 125   2 126   2 127   2 131   2 137   2 138   2 139   2
M  RAD  8 143   2 144   2 145   2 147   2 148   2 149   2 151   2 153   2
M  RAD  8 156   2 157   2 158   2 161   2 162   2 163   2 166   2 167   2
M  RAD  8 168   3 169   2 171   2 172   3 174   3 176   2 178   3 180   3
M  RAD  8 181   2 184   2 185   2 186   2 188   2 190   2 191   2 192   3
M  RAD  8 193   2 194   3 195   2 196   2 197   2 200   3 204   3 208   2
M  RAD  8 211   3 212   2 213   2 218   3 219   3 220   3 221   2 222   3
M  RAD  8 229   2 230   2 231   2 233   2 234   2 240   2 253   2 255   2
M  RAD  5 257   3 258   3 259   3 260   3 261   3
M  END
$$$$
