
     RDKit          3D

 59 62  0  0  0  0  0  0  0  0999 V2000
   -1.7567    3.3228    0.4908 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4207    2.3125   -0.1834 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1482    1.6944    0.0788 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3011    0.4226   -0.5087 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9581   -0.5215    0.5520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0226   -0.7609    1.7515 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2940   -1.5736    1.4109 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3317   -1.5308    2.5492 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2238   -0.2777    2.4894 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3940   -0.4459    1.5019 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0426    0.9025    1.1674 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1235    1.7303    0.4526 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6850    1.4881   -0.8609 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5447    0.9500   -1.8378 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0917    0.7507   -3.1429 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7777    1.0724   -3.4869 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9124    1.5962   -2.5260 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3549    1.7980   -1.2069 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2703    0.1537    1.1051 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5135   -0.7408    1.0308 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6676   -1.2556   -0.3333 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9760   -1.3840   -0.9156 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4126   -2.5281   -1.2170 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8174   -0.2022   -1.1722 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4466    1.1342   -1.0405 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4221    2.0308   -1.3547 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5695    1.4275   -1.7410 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4129   -0.2474   -1.7091 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.5195   -1.8564   -1.0241 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2784   -1.8963   -0.1221 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5056    2.2121    0.7065 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0324    0.6533   -1.3135 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5413   -0.1012   -0.9993 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5193   -1.3102    2.5565 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3112    0.2184    2.1910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0071   -2.6360    1.2503 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7584   -1.2150    0.4716 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9702   -2.4402    2.4976 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8093   -1.5657    3.5310 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6451   -0.0906    3.5019 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6093    0.6086    2.2224 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1595   -1.1135    1.9562 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0514   -0.9242    0.5590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3290    1.4161    2.1103 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9743    0.7490    0.5865 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5743    0.7149   -1.6068 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7610    0.3489   -3.8912 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4316    0.9203   -4.5007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8960    1.8431   -2.8082 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5095    1.0770    0.5338 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1435    0.4859    2.1616 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4079   -0.1551    1.3373 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4112   -1.5911    1.7399 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4614    1.4556   -0.7350 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4601    1.9676   -2.0330 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7634   -2.8994   -1.3275 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3005   -1.2743   -1.9470 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4154   -2.2547   -0.7257 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4576   -2.6650    0.6638 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
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
  5 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  2  0
 22 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 21 29  1  0
 29 30  1  0
 18  2  1  0
 28 24  1  0
 30  5  1  0
 18 13  1  0
  3 31  1  0
  4 32  1  0
  4 33  1  0
  6 34  1  0
  6 35  1  0
  7 36  1  0
  7 37  1  0
  8 38  1  0
  8 39  1  0
  9 40  1  0
  9 41  1  0
 10 42  1  0
 10 43  1  0
 11 44  1  0
 11 45  1  0
 14 46  1  0
 15 47  1  0
 16 48  1  0
 17 49  1  0
 19 50  1  0
 19 51  1  0
 20 52  1  0
 20 53  1  0
 25 54  1  0
 27 55  1  0
 29 56  1  0
 29 57  1  0
 30 58  1  0
 30 59  1  0
M  END
$$$$
