
     RDKit          3D

 52 55  0  0  0  0  0  0  0  0999 V2000
   -4.5560   -1.3462    0.8807 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6172   -0.1882    1.0146 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9350    0.9535    1.6503 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8938    1.7686    1.6127 N   0  0  0  0  0  4  0  0  0  0  0  0
   -2.8828    3.0960    2.2227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8833    1.1749    0.9344 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3145   -0.0930    0.5327 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5774   -1.1007   -0.2644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2033   -1.7770   -1.3230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5042   -2.6627   -2.0808 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1828   -2.9057   -1.8705 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5092   -3.8184   -2.7253 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4919   -2.2219   -0.8488 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2271   -1.3677   -0.0115 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8760   -2.3379   -0.7103 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7405   -1.2821   -1.1293 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.0585   -1.8773   -1.6344 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9554   -0.2758   -0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7691   -0.6373    1.0921 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0438    0.2723    2.1144 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8454   -0.0900    3.1462 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.5040    1.5553    2.0716 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6535    1.9200    1.0292 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3290    1.0050    0.0124 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3311    1.4208   -1.0038 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7153    1.5447   -2.1992 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0474    1.7240   -0.6602 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9331    2.2074   -1.7270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5120    1.7887    0.7398 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1348   -1.2494   -0.0606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9934   -2.3028    0.8786 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2634   -1.3601    1.7361 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8466    1.1683    2.1137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8422    3.2907    2.7464 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0575    3.1637    2.9623 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7454    3.8681    1.4365 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2386   -1.5848   -1.5671 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5229   -4.0284   -2.5903 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0017   -4.3033   -3.4960 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2797   -0.9007    0.8191 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2932   -0.7910   -2.0165 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4983   -2.5745   -0.8921 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8732   -2.4516   -2.5673 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7866   -1.0689   -1.8599 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2018   -1.6263    1.1566 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7283    2.2643    2.8583 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2212    2.9134    1.0290 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1244    1.3878   -2.4512 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4607    3.0633   -2.2542 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9064    2.5591   -1.3242 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1707    1.2608    1.4299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5135    2.8531    1.0497 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  4  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 11 13  1  0
 13 14  2  0
 13 15  1  0
 15 16  1  0
 16 17  1  0
 16 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  1  0
 20 22  2  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  2  0
 25 27  1  0
 27 28  1  0
 27 29  1  0
  7  2  2  0
 14  8  1  0
 24 18  1  0
 29  6  1  0
  1 30  1  0
  1 31  1  0
  1 32  1  0
  3 33  1  0
  5 34  1  0
  5 35  1  0
  5 36  1  0
  9 37  1  0
 12 38  1  0
 12 39  1  0
 14 40  1  0
 16 41  1  6
 17 42  1  0
 17 43  1  0
 17 44  1  0
 19 45  1  0
 22 46  1  0
 23 47  1  0
 28 48  1  0
 28 49  1  0
 28 50  1  0
 29 51  1  0
 29 52  1  0
M  CHG  1   4   1
M  END
$$$$
