
     RDKit          3D

 77 82  0  0  0  0  0  0  0  0999 V2000
   -5.1709   -1.7515    0.3460 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9388   -2.6178    0.5957 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9052   -2.5269   -0.5646 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.2804   -1.1553   -0.6682 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7327   -0.6622   -1.7980 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3067    0.5588   -1.5089 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6105    0.7670   -0.2128 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1964   -0.2862    0.3115 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3028    2.0249    0.5556 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.5645    2.6103    1.2237 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5135    3.2607    0.2435 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4247    2.4838   -0.4916 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2808    3.0863   -1.4202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2280    4.4691   -1.6302 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3237    5.2479   -0.9024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4658    4.6491    0.0273 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6508    3.0319   -0.2914 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4336    3.8067    0.2310 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2940    5.0404    0.4333 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6972    3.1472    0.5578 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5448    3.4537    1.6061 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4768    2.5315    1.6352 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2280    1.6980    0.6439 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1241    2.0353   -0.0617 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0590    0.4808    0.3322 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.0193    0.7418   -0.8556 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4178    1.2607   -0.4290 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3777    1.2405   -1.6261 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3597    2.6722    0.1672 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1605   -0.6376    0.0092 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5288   -2.0071    0.1962 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7402   -2.3340    0.3217 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4723   -3.0292    0.2476 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6892   -4.3755   -0.0188 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2079   -5.1595    0.0921 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.3608   -3.7601    0.5023 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1831   -2.6936    0.5226 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1160   -3.6454    0.7769 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.6496   -4.8554    1.5447 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2223   -5.7764    0.4862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3617   -4.9322   -0.7784 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8456   -3.5758   -0.5032 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9099   -0.6806    0.4239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9392   -1.9684    1.1224 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6076   -1.9679   -0.6530 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4829   -2.3086    1.5639 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2922   -3.6643    0.7087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4670   -2.6675   -1.5181 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6097    1.7188    1.3708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2477    3.3567    1.9845 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0969    1.8125    1.7832 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4656    1.4135   -0.3527 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9782    2.4805   -1.9853 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8881    4.9348   -2.3545 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2805    6.3155   -1.0631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7616    5.2647    0.5749 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1546    3.4033   -1.1298 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4584    4.2704    2.3145 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6378    0.2182    1.2459 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5531    1.4359   -1.5896 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1686   -0.2168   -1.3970 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8368    0.5724    0.3347 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4168    0.2279   -2.0725 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4042    1.5149   -1.3016 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0464    1.9538   -2.4084 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9553    2.6426    1.1991 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3775    3.1120    0.2365 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7238    3.3415   -0.4513 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1930   -0.4441   -0.3428 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6321   -4.8396   -0.2689 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2577   -2.7294    1.3931 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8667   -5.3674    2.1524 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4615   -4.5320    2.2376 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5303   -6.6287    0.3048 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2081   -6.1808    0.8077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7582   -5.3800   -1.5989 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4227   -4.9308   -1.1194 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  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
  9 17  1  0
 17 18  1  0
 18 19  2  0
 18 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 27 29  1  0
 25 30  1  0
 30 31  1  0
 31 32  2  0
 31 33  1  0
 33 34  2  0
 34 35  1  0
 35 36  1  0
 36 37  2  0
 36 38  1  0
 38 39  1  0
 39 40  1  0
 40 41  1  0
 41 42  1  0
 42  3  1  0
  8  4  1  0
 16 11  1  0
 24 20  1  0
 37 33  1  0
 42 38  1  0
  1 43  1  0
  1 44  1  0
  1 45  1  0
  2 46  1  0
  2 47  1  0
  3 48  1  6
  9 49  1  1
 10 50  1  0
 10 51  1  0
 12 52  1  0
 13 53  1  0
 14 54  1  0
 15 55  1  0
 16 56  1  0
 17 57  1  0
 21 58  1  0
 25 59  1  1
 26 60  1  0
 26 61  1  0
 27 62  1  0
 28 63  1  0
 28 64  1  0
 28 65  1  0
 29 66  1  0
 29 67  1  0
 29 68  1  0
 30 69  1  0
 34 70  1  0
 38 71  1  1
 39 72  1  0
 39 73  1  0
 40 74  1  0
 40 75  1  0
 41 76  1  0
 41 77  1  0
M  END
$$$$
