
     RDKit          3D

 87 91  0  0  0  0  0  0  0  0999 V2000
    4.1179    1.4445    0.4032 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5552    0.4796    0.9948 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3311   -0.4185    1.8092 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7968   -0.3584    1.8420 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4023   -0.8653    0.5379 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7605   -1.4575    0.9045 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7889   -1.6001    2.4262 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3900   -1.2604    2.9182 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0804    0.2306    0.7802 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.8424   -0.4592   -0.5805 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2713   -1.9476   -0.5817 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0781   -2.9098   -0.7094 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5803   -3.0231   -2.1565 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5830   -3.8445   -2.2244 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8706   -3.4642   -1.8136 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8674   -4.4456   -1.7680 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1643   -4.1219   -1.3574 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4809   -2.8104   -0.9973 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4978   -1.8095   -1.0492 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1944   -2.1405   -1.4538 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8171   -0.3972   -0.6297 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3294   -0.1268    0.8083 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.0335   -0.9684    1.7908 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3464   -1.8722    2.6992 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4366   -2.5446    3.5576 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7943   -2.0160    3.0707 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4348   -1.0661    2.0018 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2870   -0.4105    1.3459 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4506    1.3415    1.1554 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5434    1.7854    1.5992 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3585    2.2639    0.9714 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1207    1.9589    0.2391 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.6875    3.1779   -0.6038 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8028    3.6313   -1.5604 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2842    4.6546   -2.5355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2547    6.0162   -2.1890 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7490    6.9602   -3.0900 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2661    6.5512   -4.3371 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2789    5.1963   -4.6829 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7812    4.2494   -3.7845 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0477    1.5025    1.2054 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3822    1.0065    2.3199 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3352    1.4936    0.8276 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8292   -1.1459    2.3677 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1303    0.6883    2.0318 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5021   -0.0387   -0.1976 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7578   -1.6610    0.0982 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8876   -2.4476    0.4160 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5802   -0.7870    0.5666 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5190   -0.8811    2.8543 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0817   -2.6268    2.7319 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4178   -0.7524    3.9066 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8033   -2.2003    3.0094 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7065   -0.4321    1.5934 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4018    0.0854   -1.3755 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7661   -0.3655   -0.8465 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9903   -2.1272   -1.4114 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8130   -2.2017    0.3548 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2568   -2.5832   -0.0364 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3931   -3.9220   -0.3743 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3731   -3.5032   -2.7678 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3794   -2.0286   -2.6106 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6315   -5.4648   -2.0477 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9241   -4.8907   -1.3193 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4902   -2.5740   -0.6864 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4463   -1.3605   -1.4851 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9033   -0.1946   -0.7266 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3169    0.3023   -1.3333 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2524   -0.3974    0.8586 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7836   -2.6339    2.1166 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6440   -1.3001    3.3394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3906   -3.6500    3.4425 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2856   -2.2957    4.6317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4143   -2.8372    2.6612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3359   -1.4879    3.8844 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4351    3.1968    1.4390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2914    1.1319   -0.4802 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1952    2.8948   -1.2184 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3964    4.0208    0.0624 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6474    4.0651   -0.9802 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2014    2.7548   -2.1170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6246    6.3444   -1.2256 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7300    8.0086   -2.8206 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1226    7.2822   -5.0349 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1038    4.8800   -5.6451 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7779    3.2023   -4.0613 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7266    2.3273    0.3313 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  2  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 19 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  2  0
 22 29  1  0
 29 30  2  0
 29 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  2  0
 36 37  1  0
 37 38  2  0
 38 39  1  0
 39 40  2  0
 32 41  1  0
 41 42  2  0
 41 43  1  0
  8  4  1  0
 43  9  1  0
 20 15  1  0
 27 23  1  0
 40 35  1  0
  3 44  1  0
  4 45  1  0
  5 46  1  0
  5 47  1  0
  6 48  1  0
  6 49  1  0
  7 50  1  0
  7 51  1  0
  8 52  1  0
  8 53  1  0
  9 54  1  1
 10 55  1  0
 10 56  1  0
 11 57  1  0
 11 58  1  0
 12 59  1  0
 12 60  1  0
 13 61  1  0
 13 62  1  0
 16 63  1  0
 17 64  1  0
 18 65  1  0
 20 66  1  0
 21 67  1  0
 21 68  1  0
 22 69  1  6
 24 70  1  0
 24 71  1  0
 25 72  1  0
 25 73  1  0
 26 74  1  0
 26 75  1  0
 31 76  1  0
 32 77  1  6
 33 78  1  0
 33 79  1  0
 34 80  1  0
 34 81  1  0
 36 82  1  0
 37 83  1  0
 38 84  1  0
 39 85  1  0
 40 86  1  0
 43 87  1  0
M  END
$$$$
