
     RDKit          3D

 71 73  0  0  0  0  0  0  0  0999 V2000
    8.2155    0.6411   -0.6836 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1472   -0.4484    0.3867 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1838   -0.0900    1.5231 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7604   -0.0608    1.0566 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9655    1.0565    0.9256 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7620    0.5490    0.4722 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5655    1.3550    0.1411 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6857    2.6105    0.1339 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2827    0.7658   -0.1882 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8600   -0.5419    0.3354 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9014   -1.6117   -0.7712 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5181   -3.0166   -0.2733 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9230   -3.1233    0.2520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9061   -2.7109   -0.7550 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2898   -2.4957   -0.4401 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1224   -2.3561   -1.3739 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7629   -2.4513    0.9538 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5030   -3.5405    1.4398 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8610   -3.6092    2.7898 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7703   -4.9864    3.3892 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -4.4723   -2.5925    3.6661 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7493   -1.4970    3.1894 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4150   -1.3955    1.8330 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7457   -0.2346    1.4173 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0152    0.4627    0.1997 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7748    1.9603    0.4164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3826    2.8961   -0.6677 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0320    2.6053   -2.1567 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0005    1.5978   -2.8062 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0514    3.9153   -2.9625 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3611    2.2462    0.7224 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3631    2.5815   -0.2491 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0255    3.7857   -0.3907 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3478    1.5182   -1.0378 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8653   -0.7888    0.3326 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0718   -1.1183    0.6947 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4959    1.6142   -0.2288 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2358    0.7453   -1.1953 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9799    0.3685   -1.4406 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8419   -1.4108   -0.0827 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1640   -0.5871    0.8162 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2743   -0.8540    2.3243 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4660    0.8924    1.9612 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2277    2.0879    1.1281 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1720   -0.4437    0.7286 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4885   -0.8478    1.1980 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9288   -1.6622   -1.1889 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2356   -1.3228   -1.6086 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6462   -3.7364   -1.1111 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2199   -3.3243    0.5322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0228   -2.5119    1.1703 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1237   -4.1782    0.5349 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6330   -2.6988   -1.7639 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7786   -4.3498    0.7743 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7326   -2.6473    4.7168 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4675   -0.7055    3.8741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3641    0.0740   -0.6074 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0839    0.3143   -0.0738 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3505    2.2089    1.3385 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0631    3.9291   -0.4022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4906    2.8966   -0.5550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0112    2.1904   -2.2436 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9138    0.5966   -2.3490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0529    1.9487   -2.7156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7594    1.4764   -3.8835 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3080    4.6318   -2.5489 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7808    3.7250   -4.0237 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0626    4.3815   -2.9284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1420    2.5111    1.7127 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9015    1.9727   -1.8878 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3985    0.8381   -1.4861 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  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
 15 16  2  0
 15 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  1  0
 19 21  2  0
 21 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 28 30  1  0
 26 31  1  0
 31 32  1  0
 32 33  2  0
 32 34  1  0
  6 35  2  0
 35 36  1  0
 36  4  1  0
 34  9  1  0
 23 17  1  0
  1 37  1  0
  1 38  1  0
  1 39  1  0
  2 40  1  0
  2 41  1  0
  3 42  1  0
  3 43  1  0
  5 44  1  0
 10 45  1  0
 10 46  1  0
 11 47  1  0
 11 48  1  0
 12 49  1  0
 12 50  1  0
 13 51  1  0
 13 52  1  0
 14 53  1  0
 18 54  1  0
 21 55  1  0
 22 56  1  0
 25 57  1  0
 25 58  1  0
 26 59  1  0
 27 60  1  0
 27 61  1  0
 28 62  1  0
 29 63  1  0
 29 64  1  0
 29 65  1  0
 30 66  1  0
 30 67  1  0
 30 68  1  0
 31 69  1  0
 34 70  1  0
 34 71  1  0
M  END
$$$$
