
     RDKit          3D

 77 80  0  0  0  0  0  0  0  0999 V2000
    3.0827   -0.3865    0.2429 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0590    0.8148   -0.1473 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0338    1.2759   -1.1435 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8572    0.3390   -1.2337 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7936   -0.6174   -2.2574 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3062   -1.4713   -2.3558 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3533   -1.3823   -1.4287 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2702   -0.4594   -0.3661 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1669    0.4005   -0.2783 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3395   -0.4371    0.7066 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2984    0.7025    0.6436 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5189    1.2641   -0.7143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1967    2.6102   -0.6359 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5828    2.7275   -0.8506 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2060    3.9759   -0.7459 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4535    5.1136   -0.4503 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0763    5.0059   -0.2431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4499    3.7586   -0.3286 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6118    0.4152    1.3001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5664   -0.6389    2.3885 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0906   -0.3268    3.5102 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0060   -1.9940    2.1672 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9936   -2.3897    1.1566 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3508   -2.6648   -0.2145 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4536   -3.9168   -0.2079 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8420   -4.2019   -1.5998 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4472   -3.5902   -1.7895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4914   -2.1910   -1.5434 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0553    1.7383    0.3085 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1962    1.3309    1.1260 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2000    0.5220    0.2900 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3210    0.0341    1.1242 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0748   -1.0461    0.4428 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3676   -0.5140   -0.2018 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2710    0.0545    0.7348 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6290    0.6519    1.8554 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2007    1.1465    1.5624 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5257    1.3753   -2.1334 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6767    2.2888   -0.8572 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5899   -0.6909   -2.9881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3475   -2.1869   -3.1643 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1057    1.1193    0.5310 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8657   -1.4087    0.6921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8249   -0.3949    1.6926 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1010    0.5562   -1.3436 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5624    1.4423   -1.2412 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1809    1.8553   -1.0854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2731    4.0569   -0.9038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9371    6.0791   -0.3807 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4929    5.8881   -0.0236 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3820    3.6895   -0.1635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9766    1.3580    1.7728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3830    0.1374    0.5513 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7771   -2.7001    2.9037 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7758   -1.6019    1.0625 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5169   -3.3113    1.5014 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1720   -2.8175   -0.9481 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7742   -1.7839   -0.5532 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0785   -4.7892    0.0812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6534   -3.8201    0.5594 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7402   -5.3018   -1.7224 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5225   -3.8437   -2.4054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1053   -3.7792   -2.8286 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7377   -4.0698   -1.0777 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9638    2.7487    0.0550 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6918    2.2425    1.5203 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8437    0.7304    1.9927 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6472   -0.3422   -0.1385 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5728    1.1336   -0.5644 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4673   -1.5666   -0.3305 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3459   -1.8148    1.1979 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8808   -1.3503   -0.7200 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1143    0.2440   -0.9741 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6062   -0.0785    2.6927 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2426    1.5138    2.1925 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2602    1.9503    0.7921 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7877    1.5890    2.4933 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  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
  8  9  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 11 19  1  0
 19 20  1  0
 20 21  2  0
 20 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
  2 29  1  0
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  1  0
 36 37  1  0
  9  4  1  0
 18 13  1  0
 37 32  1  0
 28  7  1  0
  3 38  1  0
  3 39  1  0
  5 40  1  0
  6 41  1  0
  9 42  1  0
 10 43  1  0
 10 44  1  0
 12 45  1  0
 12 46  1  0
 14 47  1  0
 15 48  1  0
 16 49  1  0
 17 50  1  0
 18 51  1  0
 19 52  1  0
 19 53  1  0
 22 54  1  0
 23 55  1  0
 23 56  1  0
 24 57  1  0
 24 58  1  0
 25 59  1  0
 25 60  1  0
 26 61  1  0
 26 62  1  0
 27 63  1  0
 27 64  1  0
 29 65  1  0
 30 66  1  0
 30 67  1  0
 31 68  1  0
 31 69  1  0
 33 70  1  0
 33 71  1  0
 34 72  1  0
 34 73  1  0
 36 74  1  0
 36 75  1  0
 37 76  1  0
 37 77  1  0
M  END
$$$$
