
     RDKit          3D

 57 60  0  0  0  0  0  0  0  0999 V2000
    3.0270    0.8461   -2.4985 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3163    0.9805   -1.2772 S   0  0  0  0  0  6  0  0  0  0  0  0
    5.4591    0.0821   -1.6597 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8040    2.4013   -1.2489 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7413    0.5532    0.3101 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2657   -0.8452    0.3811 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.8161   -1.4896    1.6844 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7409   -2.0107    2.6490 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5980   -1.0086    2.8247 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1141   -0.4354    1.5510 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2272    0.7334    1.6779 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2145    1.0212    2.8256 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1810    1.6911    0.5593 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4634    2.2983    0.8724 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6037    2.5048    0.0428 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0838    3.8134   -0.0895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2617    4.0750   -0.7959 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9874    3.0284   -1.3702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5373    1.7120   -1.2508 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3550    1.4386   -0.5495 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7836    0.0706   -0.4756 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2250   -1.1593   -1.3192 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0875   -2.2613   -1.2498 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0485   -1.8802   -0.1607 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.8712   -1.4926    1.0754 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5728   -0.2689    0.8956 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0606   -2.8338    0.1753 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2550   -2.3812   -0.1819 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7146   -0.9208    0.2797 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1521    1.4523   -2.1850 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7264   -0.2155   -2.6140 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4009    1.2231   -3.4725 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9931    1.2311    0.5821 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6888   -1.4301   -0.4675 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4874   -2.3370    1.4232 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4452   -0.7567    2.2374 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3401   -2.9861    2.3104 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2077   -2.2020    3.6398 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9744   -0.1872    3.4744 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7582   -1.5075    3.3538 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1409    1.2587   -0.4480 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5742    2.5037    0.5396 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5458    4.6328    0.3703 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6188    5.0924   -0.8898 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8998    3.2392   -1.9130 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1051    0.9135   -1.7109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8778    0.3496   -1.0127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3973   -0.8628   -2.3767 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1735   -1.5639   -0.9056 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5350   -3.2527   -1.0206 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5737   -2.3348   -2.2328 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5527   -1.0001   -0.5633 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2323   -1.4187    1.9727 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6036   -2.2957    1.3125 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3485   -2.4287   -1.2901 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9741   -3.1454    0.1700 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4425   -0.2337   -0.5396 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  2  0
  2  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  2  0
 11 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
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 24 27  1  0
 27 28  1  0
 28 29  1  0
 29  6  1  0
 29 10  1  0
 20 15  1  0
 26 21  1  0
  1 30  1  0
  1 31  1  0
  1 32  1  0
  5 33  1  0
  6 34  1  6
  7 35  1  0
  7 36  1  0
  8 37  1  0
  8 38  1  0
  9 39  1  0
  9 40  1  0
 13 41  1  0
 13 42  1  0
 16 43  1  0
 17 44  1  0
 18 45  1  0
 19 46  1  0
 21 47  1  0
 22 48  1  0
 22 49  1  0
 23 50  1  0
 23 51  1  0
 24 52  1  6
 25 53  1  0
 25 54  1  0
 28 55  1  0
 28 56  1  0
 29 57  1  0
M  END
$$$$
