YF0005
     RDKit          3D

 54 57  0  0  1  0  0  0  0  0999 V2000
    4.6824   -0.9536   -4.3105 C   0  0  0  0  0  1  0  0  0  0  0  0
    4.7308   -0.2129   -2.9265 C   0  0  0  0  0  3  0  0  0  0  0  0
    9.4262    0.1057   -0.7730 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.1481   -0.3676   -2.6559 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4267    0.3159   -2.4260 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2650   -0.1441   -1.7534 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.6607    0.6401   -0.8076 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.5553   -0.4943   -1.1071 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.0712    1.9394   -0.8850 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8984    0.7651   -1.0549 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.4444   -1.8342   -0.2767 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.3947   -0.3580    1.5797 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.0544   -1.5450   -0.1779 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.6969    4.7154    1.5031 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8596    5.2971    2.0543 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6542    7.4409    2.4921 C   0  0  0  0  0  1  0  0  0  0  0  0
   -0.7916    3.5169    0.7673 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2395   -1.8145    0.9601 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.8801   -1.8398    1.1336 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.5324    2.6470    1.1365 C   0  0  0  0  0  1  0  0  0  0  0  0
   -3.1087    4.6837    1.9026 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.0743    2.9732    0.5864 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.0103   -3.0598    1.2984 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.2157    3.5287    1.1479 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9660   -3.3360    0.2724 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.4901   -1.8103    0.1566 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.2001   -4.0443    0.3292 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.4661    2.8730    0.9727 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.6485    0.8948    0.5670 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.8755   -3.7279    2.7114 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5575   -0.6240    0.3272 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.4299   -3.2344   -0.0153 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.6808    2.1711    0.7800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9769    2.9844    0.5951 C   0  0  0  0  0  1  0  0  0  0  0  0
   -7.6983   -3.2838   -0.7497 C   0  0  0  0  0  1  0  0  0  0  0  0
    7.4363   -0.8433   -3.7450 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7291   -1.3854    1.3329 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.0660    1.4766   -2.5653 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6788    0.3992    0.3235 S   0  0  0  0  0  0  0  0  0  0  0  0
   11.8586   -2.3198    0.2885 C   0  0  0  0  0  1  0  0  0  0  0  0
    5.8806    0.0049   -2.1669 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7931    2.1306   -1.7362 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7703   -0.7074   -1.8050 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7855    5.6165    1.6421 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.5443   -2.7995   -0.6572 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0109   -1.4365   -1.1135 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7262    6.4294    2.8259 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3148    2.7412    0.2560 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3016   -3.8855    1.4316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7512   -2.9329    2.5244 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2825   -4.5294    1.7076 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.0712   -5.0771   -0.4670 O   0  0  0  0  0  1  0  0  0  0  0  0
   -4.4039   -3.6939    3.8233 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5760   -3.9957   -0.2390 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0
  2  5  1  0
  2 41  1  0
  3  6  1  0
  3 39  1  0
  4  6  1  0
  4 36  2  0
  4 41  1  0
  5 38  2  0
  5 43  1  0
  7 41  1  0
  8 10  1  0
  8 13  1  0
  8 43  1  0
  9 10  1  0
  9 42  2  0
  9 48  1  0
 11 13  1  0
 11 18  1  0
 11 45  1  0
 11 46  1  6
 13 19  1  1
 13 45  1  0
 14 15  1  0
 14 17  2  0
 14 44  1  0
 15 21  2  0
 15 47  1  0
 16 47  1  0
 17 22  1  0
 17 48  1  0
 18 12  1  0
 18 23  1  0
 20 48  1  0
 21 24  1  0
 22 24  2  0
 23 25  1  0
 23 49  1  1
 23 50  1  0
 24 28  1  0
 25 27  1  0
 26 31  2  0
 26 32  1  0
 27 32  1  0
 27 51  1  0
 27 52  1  6
 28 33  1  0
 29 31  1  0
 29 33  2  0
 30 50  1  0
 30 51  1  0
 30 53  2  0
 32 54  1  0
 33 34  1  0
 35 54  1  0
 37 39  1  0
 37 40  1  0
M  RAD  8   1   2   2   2   3   3   6   3   7   2   8   2  10   3  12   2
M  RAD  8  16   2  18   2  19   2  20   2  21   2  22   2  25   3  26   2
M  RAD  8  28   3  29   2  31   2  32   2  34   2  35   2  40   2  51   2
M  RAD  1  52   2
M  END
$$$$
