SCPAY0055
     RDKit          3D

 44 46  0  0  1  0  0  0  0  0999 V2000
    8.6047    1.0516   -3.1661 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.6625    0.1079   -1.9565 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8277    1.9956   -3.3968 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.2265    1.9099   -1.2204 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.8219   -0.4516   -0.6618 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.8155   -2.5125    0.1168 C   0  0  0  0  0  1  0  0  0  0  0  0
    4.4299   -1.0868    0.6572 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.4389    2.8833   -1.3660 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.6430   -0.1354   -1.4606 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.1823    0.3009   -2.6388 C   0  0  0  0  0  1  0  0  0  0  0  0
    5.2330   -1.4757    1.8066 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.4458   -0.1621   -1.6213 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.7399    1.1001    1.5839 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.0252   -0.3612   -1.5073 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.4832   -2.0270    3.0596 C   0  0  0  0  0  2  0  0  0  0  0  0
  -13.8239   -0.6488    0.4282 C   0  0  0  0  0  1  0  0  0  0  0  0
  -11.0240    0.2567    0.8733 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.5262   -0.0239    0.1814 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.5498    1.5294    0.2540 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.1169    0.8996    0.1819 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.9908   -0.8062   -0.1642 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.3805   -1.0701   -0.3871 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.8384   -1.9338    1.9660 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2002   -2.3476    3.6068 C   0  0  0  0  0  3  0  0  0  0  0  0
  -12.3633   -0.1877    0.6815 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.8727   -0.5108    0.3996 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.9326    1.2703    0.1299 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.1722    1.8427    0.3160 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.1992    0.1343    0.0451 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.9730   -1.5835   -0.3924 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9785   -2.1792    2.8538 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.7906    3.3356    0.3737 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.2907   -2.9531   -1.0684 C   0  0  0  0  0  1  0  0  0  0  0  0
  -10.0454   -2.0607    0.1178 C   0  0  0  0  0  1  0  0  0  0  0  0
    6.3267   -0.7364   -2.7880 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7480    0.9637   -2.0954 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0006    0.2996   -0.7596 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4053    3.0430   -2.4969 N   0  0  0  0  0  2  0  0  0  0  0  0
    3.3718   -0.2273    1.2032 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8282    1.3380    1.4889 O   0  0  0  0  0  1  0  0  0  0  0  0
   -0.3188   -2.1365    2.3052 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3583    0.6458   -1.0072 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2157   -1.3965    0.7464 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1308   -2.7674    4.7779 O   0  0  0  0  0  1  0  0  0  0  0  0
  1  3  1  0
  1 36  1  0
  2 35  2  0
  2 36  1  0
  2 37  1  0
  3 38  1  0
  4  8  1  0
  4 36  1  0
  5  7  1  0
  5  9  1  0
  5 37  1  0
  7  6  1  6
  7 11  1  0
  7 39  1  0
  8 38  1  0
  9 12  2  0
 11 15  1  0
 12 14  1  0
 13 39  1  0
 14 10  1  0
 14 22  1  0
 15 24  1  0
 16 25  1  0
 17 25  1  0
 17 26  1  0
 17 40  1  0
 18 26  1  0
 18 27  1  0
 18 42  1  0
 19 28  1  0
 20 28  1  0
 20 29  2  0
 21 29  1  0
 21 30  2  0
 22 30  1  0
 22 43  1  0
 23 31  1  0
 23 41  2  0
 23 43  1  0
 24 31  1  0
 24 44  1  0
 26 34  1  0
 27 19  1  0
 27 42  1  0
 28 32  1  0
 30 33  1  0
M  RAD  8   1   3   3   3   4   3   5   2   6   2   8   3   9   2  10   2
M  RAD  8  11   3  12   2  13   2  14   2  15   3  16   2  17   2  18   2
M  RAD  8  19   3  20   2  21   2  22   2  24   2  25   3  26   2  27   2
M  RAD  8  28   2  29   2  31   3  32   2  33   2  34   2  38   2  40   2
M  RAD  1  44   2
M  END
$$$$
