
     RDKit          3D

 63 64  0  0  0  0  0  0  0  0999 V2000
    1.2355    3.7590    1.9194 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6298    2.8919    0.9784 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3992    3.2358   -0.4019 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9699    2.2935   -1.3864 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8184    1.7987   -2.1758 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4968    2.0352   -1.6223 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.0649    3.0571   -2.6091 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2460    2.0619   -0.3607 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5181    3.2442    0.2437 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5032    0.8533    0.3606 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8062    0.5872    1.3737 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7133    0.0046    0.0197 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.7595    0.1190    1.1735 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.0585   -0.1364    0.7052 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4457   -0.7919    2.3376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0649   -2.0741    2.4667 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6231   -0.4169    3.2148 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3749   -1.4067   -0.3077 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4293   -2.2783   -0.8411 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0340   -1.7966   -0.6651 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5816   -1.4567   -1.7913 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1959   -2.6999    0.2132 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.9943   -3.9061    0.7032 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3283   -2.0073    1.3484 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5166   -1.2606    1.3495 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1879   -1.2143    2.4149 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0233   -0.5449    0.1131 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.9938   -1.4205   -0.6869 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1036   -0.4716   -1.1581 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.4674   -1.1577   -1.2554 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0972    0.6865   -0.1626 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7727    0.6703    0.4293 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3668    1.6595    1.3831 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7293    1.5147    2.5855 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7235    4.6730    1.6475 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3984    3.5722    2.9728 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2284    4.2417   -0.6395 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6062    1.0348   -2.0923 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5586    2.9585   -3.5928 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9171    4.0929   -2.2341 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1509    2.8763   -2.7569 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4364    3.4754   -0.0506 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1634    0.4596   -0.8915 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7454    1.1638    1.5680 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3287    0.6455    0.1556 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8054   -2.7035    3.2578 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7982   -2.3947    1.7977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1382   -2.6818   -1.8350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6052   -3.1284   -0.1550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3819   -1.7337   -0.9902 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6499   -3.1049   -0.3864 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4385   -4.4536   -0.1553 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3210   -4.6021    1.2469 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7954   -3.5847    1.4002 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1688   -0.2591   -0.5207 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4197   -2.2224   -0.0411 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4854   -1.8961   -1.5550 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8295   -0.0776   -2.1619 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4224   -1.9741   -2.0055 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7658   -1.5859   -0.2741 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2356   -0.4232   -1.5785 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2780    1.6545   -0.6789 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8557    0.5454    0.6391 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  6  8  1  0
  8  9  1  0
  8 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15 17  2  0
 12 18  1  0
 18 19  1  0
 18 20  1  0
 20 21  2  0
 20 22  1  0
 22 23  1  0
 22 24  1  0
 24 25  1  0
 25 26  2  0
 25 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  1  0
 29 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  2  0
 33  2  1  0
 32 27  1  0
  1 35  1  0
  1 36  1  0
  3 37  1  0
  6 38  1  6
  7 39  1  0
  7 40  1  0
  7 41  1  0
  9 42  1  0
 12 43  1  6
 13 44  1  1
 14 45  1  0
 16 46  1  0
 16 47  1  0
 19 48  1  0
 19 49  1  0
 19 50  1  0
 22 51  1  6
 23 52  1  0
 23 53  1  0
 23 54  1  0
 27 55  1  6
 28 56  1  0
 28 57  1  0
 29 58  1  6
 30 59  1  0
 30 60  1  0
 30 61  1  0
 31 62  1  0
 31 63  1  0
M  END
$$$$
