YLP0433
     RDKit          3D

170181  0  0  1  0  0  0  0  0999 V2000
   -4.3831   -0.5746    8.5030 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.6110   -3.5947    1.9754 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0495   -5.3497    6.0165 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.3946   -2.5577    5.0692 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.4442    3.0201    9.5035 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5483   -5.3005    5.5579 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4050   -3.3479    7.0566 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.7366   -7.6283    1.9158 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.8726   -5.9694    7.2582 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.4638   -2.0298    4.3034 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.6097   -7.6643    0.6349 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.1734   -7.1119    1.5136 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.1704   -7.8954    0.5143 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.4082   -1.9336    7.7354 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.1554   -2.8385    3.4201 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.4211   -6.5747   -1.3315 C   0  0  0  0  0  1  0  0  0  0  0  0
   -0.6386   -4.6339    3.8279 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.7354   -6.3130    5.4160 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5281   -3.7522   -0.4271 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.4282   -4.6803    6.4758 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.9164    2.7543    6.9816 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.1699    0.7471    9.2995 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.0023   -3.8687    4.8078 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7317    2.9199    8.2575 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.5337   -6.8136   -0.7187 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9503   -6.6921    2.5150 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.3718   -7.8483    1.4886 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.8553   -8.4976    0.6885 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8359   -9.9945    0.7417 C   0  0  0  0  0  1  0  0  0  0  0  0
   -5.4108   -6.4453    3.9994 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.7716   -4.1470    3.1752 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.2295   -4.1044    3.2801 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.0747   -5.4485    6.2837 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4482   -6.6321    7.4454 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1105   -4.4510    5.4713 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.9659   -6.7979   -0.3736 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.5777   -8.0869    2.3910 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4896    4.1851    9.9692 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9869   -4.2804    0.8880 N   0  0  0  0  0  2  0  0  0  0  0  0
    6.0185   -5.5518   -0.7593 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0039    1.9677   10.1142 N   0  0  0  0  0  2  0  0  0  0  0  0
    3.1058   -6.3718   -1.7674 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3802   -7.5324    8.2809 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6168   -5.0776    5.9236 N   0  0  0  0  0  2  0  0  0  0  0  0
   -2.2791   -5.3591    7.3614 N   0  0  0  0  0  2  0  0  0  0  0  0
    4.4001   -5.8000    6.3144 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4586   -6.8694    1.2924 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9385   -7.5536    0.2885 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4936   -8.3643    1.4908 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.6499   -9.6947    0.8434 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9724   -4.5154    4.5256 N   0  0  0  0  0  2  0  0  0  0  0  0
   -6.3443   -7.2438    5.9590 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6931   -6.3386    6.8820 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.9581   -2.5368    1.9990 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8921   -6.1511    5.2826 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0437   -3.2508   -4.9855 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.3047   -4.1117   -6.8105 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.5255   -4.2998   -4.0706 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.3943   -0.6859   -1.3470 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5171   -3.3632   -3.6407 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.4478   -3.1572   -6.2813 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.4678   -3.0234   -5.3828 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5689   -2.5346   -4.4414 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1936   -2.4358   -5.3977 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0172   -2.5105   -2.1902 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.1618   -1.5916   -2.5408 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.2171    4.1474   -0.5923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8118   -1.1656   -4.5662 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5328   -0.7728   -4.0157 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.0165   -0.7211   -3.8327 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9035    4.2683   -1.4157 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.0155   -0.4729   -2.9683 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.8646   -0.8512   -3.8726 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.3828   -0.3479   -4.6700 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7985   -0.3117   -4.3850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9568    2.5689   -3.4844 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8037    4.5713   -2.3389 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.4585    0.5998   -5.6673 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.8814    0.5458   -5.5039 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2270    0.2536   -5.6126 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2906    1.4231   -6.1758 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.1439    5.9716   -2.3065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2504    1.3974   -4.2511 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.7269    1.0638   -6.0837 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.6451    2.5625   -7.1608 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.1719    0.3555   -7.8597 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.0798    2.7082   -8.5088 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.8846    5.1625   -8.3955 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.8728    6.1312   -2.8002 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.5307    1.4364   -8.8926 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.6681    6.0566   -7.1436 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.6625    5.4911   -4.6826 C   0  0  0  0  0  1  0  0  0  0  0  0
   -4.4252    5.7341   -2.9778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5102    6.3645   -0.8755 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1330    3.8748   -7.8232 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.8048    5.7846   -5.9589 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7567    6.5815   -4.9539 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.5125    6.0779   -4.2320 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9817    4.6530   -6.4809 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.4289    5.8822   -3.7752 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9566    5.5545   -2.9810 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.7384    5.4209   -0.0906 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.2231    6.2957   -3.1309 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0839    6.1597   -2.3677 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4921    5.0423   -0.8168 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.2945    7.6119   -2.6377 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.0359    7.5410   -1.9865 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9087    9.4031   -0.8684 C   0  0  0  0  0  1  0  0  0  0  0  0
   -0.8293    8.2280   -2.0894 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.5569   -3.9888   -6.3413 N   0  0  0  0  0  3  0  0  0  0  0  0
    2.1278   -3.3460   -1.6475 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7521   -2.9622   -4.3606 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5422    2.9992   -0.0762 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3735   -2.3924   -2.6570 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1403   -1.3766   -3.7339 N   0  0  0  0  0  0  0  0  0  0  0  0
  -13.0053    5.2364   -0.4756 O   0  0  0  0  0  1  0  0  0  0  0  0
  -11.1698    2.3854   -3.6730 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1932   -0.3526   -4.4194 N   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5206    6.8304   -1.4970 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2386    3.6087   -3.1010 N   0  0  0  0  0  2  0  0  0  0  0  0
    4.0765    0.7330   -6.1410 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4347    0.2277   -6.3891 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2566    6.2403   -3.2618 N   0  0  0  0  0  2  0  0  0  0  0  0
    6.2152    3.8908   -8.8685 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6354    5.9726   -2.2208 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2821    5.9740   -4.1988 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5841    7.5342   -0.5351 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9727    6.9763   -5.7315 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.2845    5.3582   -2.1669 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1616    8.1648   -1.5034 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7070    0.6800   -1.4748 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.7996    1.5337   -0.3537 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.5321    0.9875    0.9042 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.3526   -0.3821    1.0724 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.2600   -1.1997   -0.0430 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.0479  -10.3588   -0.5969 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.3300  -12.1989    0.6145 C   0  0  0  0  0  1  0  0  0  0  0  0
   -0.8859   -9.5738   -1.5381 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.4105   -7.6558   -2.3101 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.2121    3.7116    0.6379 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.9961    1.2488    1.2977 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.9352   -0.4912    0.5536 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.0544   -4.3838   -1.2473 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.2859   -6.1109   -2.2808 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.2790    2.3364    1.3588 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.5426    1.4301    1.8422 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.7920   -2.0339    0.6309 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.8411   -3.7976   -0.0630 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.3903    5.8659    0.6561 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.9292    7.7849    3.2472 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.3953    6.3643    4.0033 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.8168    3.0609    6.6768 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.7131    2.7291    7.0778 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.9359    7.0558    1.4462 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.5683    7.9929    2.5370 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.6172    4.8630    4.2199 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.8104    3.2899    5.4652 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.2351    2.5565    6.5911 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.6616   -8.9508   -2.4221 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8873  -10.9313    0.2363 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2281    1.2014    1.9288 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5079   -3.2928    0.9536 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1544    4.8185   -0.0154 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9904    0.8282    0.4834 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1972   -4.7740   -2.1919 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2863    8.1550    2.1351 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7006    3.5795    4.5017 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9745    2.3636    6.0936 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0952    7.6562    3.9285 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9130    2.9523    7.6722 O   0  0  0  0  0  0  0  0  0  0  0  0
  1 22  1  0
  2 39  1  0
  2 54  2  0
  3 35  1  0
  3 53  1  0
  4 23  2  0
  4 10  1  0
  5 38  2  0
  5 24  1  0
  5 41  1  0
  6  3  1  0
  6 46  2  0
  6 51  1  0
  7 14  1  0
  8 37  1  0
  8 12  1  0
  9 34  1  0
  9 45  1  0
 10 15  2  0
 11 48  1  0
 12 47  1  0
 13 28  1  0
 13 36  1  0
 13 49  1  0
 14  1  1  0
 15 31  1  0
 16 40  1  0
 17 31  2  0
 18 44  1  0
 18 52  2  0
 19 39  1  0
 19111  1  0
 20  7  1  0
 20 44  1  0
 22 41  1  0
 23 17  1  0
 24 21  1  0
 25 42  2  0
 25 48  1  0
 26 47  1  0
 27 37  1  0
 27 11  1  0
 28 48  1  0
 28 50  2  0
 29 49  1  0
 30 18  1  0
 30 26  1  0
 32  2  1  0
 32 51  1  0
 33 45  1  0
 33 20  1  0
 33 55  2  0
 34 43  2  0
 34 53  1  0
 35 23  1  0
 36 40  1  0
 36 25  1  0
 56 58  1  0
 56 60  1  0
 57 61  2  0
 57110  1  0
 58 60  1  0
 59 66  1  0
 59131  2  0
 60114  1  0
 61 64  1  0
 62 63  1  0
 62 64  2  0
 62110  1  0
 63112  2  0
 63115  1  0
 64 68  1  0
 65 66  1  0
 65111  1  0
 66 70  1  0
 66114  1  0
 67 71  1  0
 67113  2  0
 67116  1  0
 68 73  2  0
 68 74  1  0
 69 74  2  0
 69 75  1  0
 70 75  2  0
 70118  1  0
 72115  1  0
 73115  1  0
 74 78  1  0
 75 79  1  0
 76 83  1  0
 76117  2  0
 76120  1  0
 77 71  1  0
 77 82  1  0
 77120  1  0
 78 84  2  0
 79 84  1  0
 79121  2  0
 80118  2  0
 80121  1  0
 80122  1  0
 81 85  1  0
 81122  1  0
 82119  2  0
 82123  1  0
 85 87  1  0
 86 90  1  0
 86122  1  0
 87 90  1  0
 87124  1  0
 88 91  1  0
 88124  1  0
 89123  1  0
 89125  1  0
 91 96  1  0
 92 96  1  0
 93125  1  0
 93126  2  0
 93129  1  0
 94102  1  0
 94125  1  0
 94127  2  0
 95 99  1  0
 95124  1  0
 96 99  1  0
 96128  1  0
 97 98  1  0
 97128  1  0
 98100  3  0
100103  1  0
101103  2  0
101104  1  0
102105  1  0
103106  1  0
104107  2  0
104129  1  0
105129  1  0
106109  2  0
107109  1  0
107130  1  0
108130  1  0
131132  1  0
132133  2  0
133134  1  0
134135  2  0
135 59  1  0
136138  1  0
136160  1  0
137160  1  0
138159  1  0
139159  1  0
139144  1  0
140145  1  0
140163  1  0
141146  1  0
141164  1  0
142147  1  0
142164  1  0
143148  1  0
143165  1  0
144165  1  0
145161  1  0
146161  1  0
147162  1  0
148162  1  0
149154  1  0
149163  1  0
150155  1  0
150169  1  0
151156  1  0
151169  1  0
152157  1  0
152170  1  0
153158  1  0
153170  1  0
154166  1  0
155166  1  0
156167  1  0
157167  1  0
158168  1  0
168 21  1  0
M  RAD  8   1   3   3   2   4   2   7   3   8   3   9   3  10   2  11   3
M  RAD  8  12   3  13   2  14   3  15   2  16   2  17   2  19   3  20   2
M  RAD  8  21   3  22   3  24   3  26   3  27   3  29   2  30   3  31   2
M  RAD  8  32   3  35   3  36   2  39   2  41   2  44   2  45   2  51   2
M  RAD  8  53   2  56   3  57   2  58   3  60   2  61   2  65   3  69   2
M  RAD  8  71   3  72   2  73   2  77   2  78   2  81   3  83   2  84   2
M  RAD  8  85   3  86   3  87   2  88   3  89   3  90   3  91   3  92   2
M  RAD  8  95   3  97   3  99   3 101   2 102   3 105   3 106   2 108   2
M  RAD  8 109   2 110   2 116   2 120   2 123   2 128   2 131   2 132   2
M  RAD  8 133   2 134   2 135   2 136   3 137   2 138   3 139   3 140   3
M  RAD  8 141   3 142   3 143   3 144   3 145   3 146   3 147   3 148   3
M  RAD  8 149   3 150   3 151   3 152   3 153   3 154   3 155   3 156   3
M  RAD  2 157   3 158   3
M  END
$$$$
