
     RDKit          3D

 72 76  0  0  0  0  0  0  0  0999 V2000
   -4.7921    4.9317   -3.6691 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -4.5535    3.2436   -3.2790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1162    2.8707   -2.0039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9123    1.5109   -1.6780 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3703    1.1335   -0.3482 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6417    1.8090    0.7777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1222    1.3835    2.0923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9901    2.2415    3.0052 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7781    0.0117    2.3448 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9337   -0.3879    3.4769 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.8528   -1.9284    3.5978 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1982   -2.6405    2.3805 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1826   -3.3062    2.6781 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3911   -2.7008    1.9113 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.6361   -3.5779    2.0845 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1062   -2.5001    0.4420 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8958   -3.5052   -0.2880 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9385   -1.1884   -0.1136 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0054   -0.2277   -0.1726 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8082   -0.2107   -1.3251 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8120    0.7511   -1.4978 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6220    0.7144   -2.6887 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2019    1.8651   -3.3222 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0503    1.6840   -4.4208 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6872    2.7714   -5.0850 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9292    3.0285   -2.9194 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0327    1.6948   -0.4819 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2316    1.7047    0.6597 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2105    0.7522    0.8393 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4467    0.7639    2.1190 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0767    0.4578    2.1578 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5516    0.2137    3.3921 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1516    0.3804    4.5438 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4516    0.7674    4.5440 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1268    0.9438    3.3369 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1477    0.5217   -2.6714 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9679   -0.8838   -2.4134 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4466   -1.7420   -3.2713 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4805   -2.9516   -2.7329 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0395   -2.8999   -1.5301 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3510   -1.6045   -1.3423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5652    0.9214   -3.9546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7761    2.2699   -4.2523 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9051    3.6521   -1.2835 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7348    0.2599   -0.2937 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2411    2.7071    0.7463 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2046   -0.7240    1.7393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4095   -0.0089    4.4088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3445   -2.1922    4.5490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8925   -2.3129    3.7112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1563   -1.9639    1.5058 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8921   -3.4499    2.0616 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1048   -4.3988    2.4369 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4219   -3.2553    3.7685 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6367   -1.7371    2.3805 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4508   -4.6073    1.7017 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4990   -3.1362    1.5328 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9077   -3.6403    3.1612 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2084   -1.0970   -0.8567 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6420   -0.9485   -2.1033 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7061   -0.1941   -3.1976 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4346    3.2410   -4.4094 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9316    3.5267   -5.3922 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2067    2.3983   -5.9935 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8353    2.4155   -0.5530 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4159    2.4623    1.4118 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4781    0.3424    1.2384 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9767    0.8845    5.4824 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1848    1.1659    3.3600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8565   -1.2136   -0.4683 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7439    0.1807   -4.7231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1119    2.5571   -5.2372 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 14 16  1  0
 16 17  2  0
 16 18  1  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 23 26  2  0
 21 27  2  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 30 31  2  0
 31 32  1  0
 32 33  2  0
 33 34  1  0
 34 35  2  0
  4 36  2  0
 36 37  1  0
 37 38  1  0
 38 39  2  0
 39 40  1  0
 40 41  2  0
 36 42  1  0
 42 43  2  0
 43  2  1  0
 32 10  1  0
 41 37  1  0
 29 19  1  0
 35 30  1  0
  3 44  1  0
  5 45  1  0
  6 46  1  0
  9 47  1  0
 10 48  1  1
 11 49  1  0
 11 50  1  0
 12 51  1  0
 12 52  1  0
 13 53  1  0
 13 54  1  0
 14 55  1  1
 15 56  1  0
 15 57  1  0
 15 58  1  0
 18 59  1  0
 20 60  1  0
 22 61  1  0
 25 62  1  0
 25 63  1  0
 25 64  1  0
 27 65  1  0
 28 66  1  0
 31 67  1  0
 34 68  1  0
 35 69  1  0
 41 70  1  0
 42 71  1  0
 43 72  1  0
M  END
$$$$
