
     RDKit          3D

 83 86  0  0  0  0  0  0  0  0999 V2000
   -6.0380    4.3738    1.5778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6528    3.2325    0.6236 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9119    2.7092   -0.0961 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9184    2.0977    1.3949 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7638    1.4089    0.6194 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6628    2.3596    0.3924 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3637    2.0160   -0.1234 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5346    2.9457   -0.3605 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9245    0.5972   -0.3509 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3548   -0.0058    0.9364 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1313   -1.4635    0.7271 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6318   -1.5306    0.8051 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1960   -1.7421    1.9142 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4209   -1.2255   -0.3544 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8640   -1.0036   -0.2762 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1515    0.4566    0.1261 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8145    1.4997   -1.0126 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9454    2.5562   -1.3003 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1977    2.3566   -0.3984 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6728    2.1597    1.0291 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5893    0.6598    0.6976 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6624    0.8838   -0.4023 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5944    0.0996   -1.7396 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0974    0.7200    0.1681 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4678   -2.3417    1.7391 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2639   -3.4994    1.4291 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8896   -4.0823    2.3511 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3204   -4.0582    0.0677 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2374   -4.8551   -0.3364 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2419   -5.4909   -1.5780 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3295   -5.3254   -2.4379 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4047   -4.5174   -2.0634 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4193   -3.8595   -0.8235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5308   -3.0271   -0.5813 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7962   -2.2499    0.5771 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0470   -1.4020    0.3553 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8719   -0.4827   -0.7691 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2403    0.8101   -0.6909 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1042    1.4808   -1.7528 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5347    5.1921    1.0156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7355    4.0106    2.3634 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1317    4.7984    2.0659 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9763    3.6618   -0.1471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4530    3.5501   -0.5740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6348    1.9901   -0.9017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6000    2.2022    0.6234 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6546    1.3448    1.7433 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4691    2.5080    2.3262 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3792    0.6024    1.2741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8018    3.3609    0.6619 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7601   -0.0210   -0.7249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1428    0.5878   -1.1383 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4741    0.6399    1.2986 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1390    0.0280    1.7217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1540   -1.8150   -0.2854 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9298   -0.9673   -1.2468 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3141   -1.7069    0.4621 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3117   -1.2500   -1.2586 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4660    0.6692    0.9765 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5530    0.9845   -1.9592 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8898    2.0445   -0.7247 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5441    3.5763   -1.1201 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2464    2.5249   -2.3709 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9889    3.1260   -0.5109 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4399    2.3839    1.8024 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7118    2.6780    1.2706 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8653   -0.0095    1.5424 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4098    0.4473   -2.4093 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7395   -0.9851   -1.5461 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6673    0.2161   -2.3163 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3145   -0.3597    0.3458 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8499    1.1109   -0.5538 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2468    1.2603    1.1277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3487   -2.0889    2.7452 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6090   -5.0024    0.3225 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5943   -6.1199   -1.8698 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3367   -5.8160   -3.4028 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2366   -4.3957   -2.7446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9743   -2.9295    1.4371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9438   -1.5865    0.8000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9009   -2.0757    0.1383 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2937   -0.8566    1.2845 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2436   -0.7742   -1.6990 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 22 24  1  0
 11 25  1  0
 25 26  1  0
 26 27  2  0
 26 28  1  0
 28 29  2  0
 29 30  1  0
 30 31  2  0
 31 32  1  0
 32 33  2  0
 33 34  1  0
 34 35  1  0
 35 36  1  0
 36 37  1  0
 37 38  1  0
 38 39  2  0
 38  5  1  0
 21 16  1  0
 33 28  1  0
 22 19  1  0
  1 40  1  0
  1 41  1  0
  1 42  1  0
  2 43  1  0
  3 44  1  0
  3 45  1  0
  3 46  1  0
  4 47  1  0
  4 48  1  0
  5 49  1  0
  6 50  1  0
  9 51  1  0
  9 52  1  0
 10 53  1  0
 10 54  1  0
 11 55  1  0
 14 56  1  0
 15 57  1  0
 15 58  1  0
 16 59  1  0
 17 60  1  0
 17 61  1  0
 18 62  1  0
 18 63  1  0
 19 64  1  0
 20 65  1  0
 20 66  1  0
 21 67  1  0
 23 68  1  0
 23 69  1  0
 23 70  1  0
 24 71  1  0
 24 72  1  0
 24 73  1  0
 25 74  1  0
 29 75  1  0
 30 76  1  0
 31 77  1  0
 32 78  1  0
 35 79  1  0
 35 80  1  0
 36 81  1  0
 36 82  1  0
 37 83  1  0
M  END
$$$$
