HMLIN0291
     RDKit          3D

 45 46  0  0  1  0  0  0  0  0999 V2000
   -8.5327    4.3722   -0.6847 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.8625    2.0005    0.0593 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6120    2.2272    3.3664 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.3517   -0.0409    4.6163 C   0  0  0  0  0  1  0  0  0  0  0  0
   -7.5961    3.3191   -0.3367 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7786    1.0955    0.2893 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.1263    0.6941    3.1940 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.7077    2.1065   -0.2601 C   0  0  0  0  0  3  0  0  0  0  0  0
   10.2693    1.9940   -0.3012 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2512    3.6834   -0.4492 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.4081    1.4434    0.1523 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0982    0.8514    0.2053 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2793   -0.0351    1.9447 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.7314   -0.8859    0.3113 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4492   -1.1319   -0.8498 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.2356    1.1130   -0.6522 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.5185   -0.6593   -1.2438 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.2058    2.7814   -0.1975 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.0879   -0.3145    0.5147 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.0282   -0.8076    1.5346 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1067   -0.9274   -0.1245 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.8011    0.1250   -0.9282 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.2321    0.1440   -0.9927 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2547   -1.6312   -0.0722 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.3721   -3.0478   -0.7995 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.2874   -6.0971   -2.7680 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4427   -4.4166   -1.5994 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.3722   -0.0009    0.8350 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2015    1.4095   -0.9629 O   0  0  0  0  0  1  0  0  0  0  0  0
  -10.1234    2.2446    1.3705 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5365    1.3748    0.3432 S   0  0  0  0  0  0  0  0  0  0  0  0
    9.5529    2.9440   -0.0499 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3377    5.4867   -1.0539 O   0  0  0  0  0  1  0  0  0  0  0  0
   -2.6254    1.9545   -0.0956 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9486   -1.4445   -0.4386 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9583    0.0515    1.2103 N   0  0  0  0  0  2  0  0  0  0  0  0
   10.0039    0.6998   -0.6966 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4064    0.5130    0.3425 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.5450   -0.2150    1.4463 N   0  0  0  0  0  2  0  0  0  0  0  0
    6.4990   -1.4199   -1.6179 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0052   -2.0284    1.7443 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5223   -0.9358   -1.4772 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8714   -6.2540   -3.9148 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4261   -6.6711   -1.7148 N   0  0  0  0  0  1  0  0  0  0  0  0
   -2.4893   -5.6643   -2.3959 N   0  0  0  0  0  2  0  0  0  0  0  0
  1  5  1  0
  1 33  1  0
  2  5  2  0
  2  6  1  0
  2 31  1  0
  3  7  1  0
  4  7  1  0
  5 10  1  0
  6 11  2  0
  8  9  1  0
  8 16  2  0
  9 32  2  0
  9 37  1  0
 10 18  2  0
 11 18  1  0
 11 38  1  0
 12 19  1  0
 12 34  2  0
 12 38  1  0
 13 20  1  0
 13 39  1  0
 13  7  1  0
 14 21  1  0
 14 35  2  0
 14 39  1  0
 15 21  1  0
 15 40  1  0
 16 23  1  0
 17 22  1  0
 17 40  1  0
 19 36  1  0
 19 24  1  0
 20 36  1  0
 20 41  2  0
 22 37  1  0
 23 37  1  0
 23 42  2  0
 24 25  1  0
 25 27  1  0
 26 43  2  0
 26 44  1  0
 26 45  1  0
 27 45  1  0
 28 31  2  0
 29 31  1  0
 30 31  2  0
M  RAD  8   1   3   3   2   4   2   6   2   7   2   8   2  10   2  13   2
M  RAD  8  15   3  16   2  17   3  18   2  19   2  21   3  22   3  24   3
M  RAD  8  25   3  27   3  29   2  33   2  36   2  38   2  39   2  44   3
M  RAD  1  45   2
M  END
$$$$
