
     RDKit          3D

 61 63  0  0  0  0  0  0  0  0999 V2000
   -3.5459    4.9446   -0.0321 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1026    3.5989    0.0903 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6030    3.0743    1.2851 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5346    3.7922    2.3200 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1468    1.6390    1.3324 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.0523    0.8707    2.3345 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1403   -0.9425    2.0598 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2290   -0.9029    0.5877 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1995   -2.1189   -0.3336 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3163   -2.2454   -1.1867 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3873   -3.2520   -2.1483 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3401   -4.1548   -2.2900 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2188   -4.0550   -1.4686 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1167   -3.0418   -0.4992 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9246   -3.1007    0.3709 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8269   -4.0573    1.1821 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8795   -2.1708    0.3118 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8191   -1.0607   -0.5787 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1723   -0.0015   -0.0464 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.5443   -0.4741   -0.2604 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6641    0.4232   -0.2780 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4764    1.6749   -0.2968 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0599   -0.1344   -0.1757 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.3675   -0.5801    1.2560 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8063   -0.1480    1.5247 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1124    0.9521    0.5137 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0711    0.8637   -0.4927 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2631    1.3770   -1.8147 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0706    0.6106   -2.8114 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8199    2.5165   -2.1145 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0348    0.3266    1.4682 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7219    1.6054    1.7213 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4096    5.1215    0.6405 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7214    5.6404    0.2236 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8608    5.1314   -1.0780 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2672    1.2497    0.3087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6836    1.0446    3.3679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0935    1.2596    2.2936 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2617   -0.7729    0.9799 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0229   -0.0122   -0.0355 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1424   -1.5465   -1.1146 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2562   -3.3251   -2.7909 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3979   -4.9362   -3.0368 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4213   -4.7789   -1.5895 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8157   -0.6117   -0.7093 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4954   -1.4137   -1.5805 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0239    0.9180   -0.6553 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7374   -1.5063   -0.2165 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1671   -0.9986   -0.8698 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6982   -0.0747    1.9884 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2521   -1.6808    1.3664 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4874   -1.0103    1.3568 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9294    0.2161    2.5675 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0753    1.9531    0.9956 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1143    0.7925    0.0585 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1206   -0.4615   -2.5209 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6072    0.6890   -3.8186 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1014    1.0242   -2.8460 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9609    0.4051    1.9557 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5172   -0.4946    2.0242 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1966    2.3503    1.2040 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  2  0
 21 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 28 30  2  0
 19 31  1  0
 31 32  1  0
 32  5  1  0
 14  9  1  0
 27 23  1  0
  1 33  1  0
  1 34  1  0
  1 35  1  0
  5 36  1  6
  6 37  1  0
  6 38  1  0
  8 39  1  0
  8 40  1  0
 10 41  1  0
 11 42  1  0
 12 43  1  0
 13 44  1  0
 18 45  1  0
 18 46  1  0
 19 47  1  6
 20 48  1  0
 23 49  1  6
 24 50  1  0
 24 51  1  0
 25 52  1  0
 25 53  1  0
 26 54  1  0
 26 55  1  0
 29 56  1  0
 29 57  1  0
 29 58  1  0
 31 59  1  0
 31 60  1  0
 32 61  1  0
M  END
$$$$
