
     RDKit          3D

 77 80  0  0  0  0  0  0  0  0999 V2000
   -4.6166   -3.6716   -0.9332 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5275   -2.6328   -1.2238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8115   -1.2039   -0.6724 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1278   -0.6698   -1.2787 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7592   -1.1042    0.8981 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3936   -1.0312    1.4491 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2913   -1.8089    0.9678 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0700   -2.9452    1.4599 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3557   -1.2507   -0.0703 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9657   -0.6896    0.5105 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9304   -1.8107    0.8344 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9604   -2.2542    2.0183 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8075   -2.3943   -0.1637 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0031   -3.1295    0.2730 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2132   -2.1846    0.4755 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0571   -0.7642   -0.0589 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5424    0.3023    0.7190 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4662    1.6162    0.2577 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9007    1.8893   -0.9877 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4156    0.8506   -1.7774 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5061   -0.4819   -1.3396 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9512   -1.5811   -2.2133 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6617   -2.1637   -1.6153 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7184    0.1283    1.7096 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3446    1.4053    1.9225 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8694    1.6448    3.0450 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3473    2.4591    0.8782 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4383    3.3399    0.7778 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4403    4.3582   -0.1800 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3508    4.5194   -1.0341 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2428    3.6769   -0.9222 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2203    2.6625    0.0524 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9031    1.8496    0.2337 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2610    2.2666    0.0972 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9802    2.0162    1.4265 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3179    1.4431    1.2217 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4470    2.3635    1.0465 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6019    0.0419    1.4603 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6500   -0.2604    2.0959 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3270   -4.6375   -1.3994 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5904   -3.3642   -1.3666 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7362   -3.8479    0.1534 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4058   -2.5671   -2.3272 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5710   -3.0276   -0.8399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0175   -0.5504   -1.0834 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1636    0.4335   -1.2004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1913   -0.9059   -2.3607 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0119   -1.0984   -0.7632 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2072   -2.0333    1.3083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3447   -0.8510    2.4774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1471   -2.0483   -0.8128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8591   -0.4462   -0.6343 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4329   -0.0387   -0.2626 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2596   -3.9065   -0.4831 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7985   -3.7004    1.2058 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4249   -2.1523    1.5667 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1093   -2.6355   -0.0033 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9864    0.1169    1.6901 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8454    2.4266    0.8673 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8372    2.9124   -1.3373 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9755    1.0852   -2.7399 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7151   -2.3798   -2.3249 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7376   -1.2137   -3.2425 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4374   -3.1310   -2.1163 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8267   -1.4840   -1.8590 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3227   -0.3429    2.5540 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2943    3.2323    1.4331 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2925    5.0186   -0.2634 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3642    5.3010   -1.7831 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5889    3.8106   -1.6007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3349    3.3486   -0.1518 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7295    1.6941   -0.7279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3788    1.3795    2.1042 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0626    2.9829    1.9729 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0591    2.3920    1.9694 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0958    3.3930    0.8244 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0769    2.0341    0.1963 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
  3  5  1  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  2  0
 11 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  1  0
 10 24  1  0
 24 25  1  0
 25 26  2  0
 25 27  1  0
 27 28  2  0
 28 29  1  0
 29 30  2  0
 30 31  1  0
 31 32  2  0
 32 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  1  0
 36 37  1  0
 36 38  1  0
 38 39  2  0
 38  5  1  0
 23 13  1  0
 32 27  1  0
 21 16  1  0
  1 40  1  0
  1 41  1  0
  1 42  1  0
  2 43  1  0
  2 44  1  0
  3 45  1  0
  4 46  1  0
  4 47  1  0
  4 48  1  0
  5 49  1  0
  6 50  1  0
  9 51  1  0
  9 52  1  0
 10 53  1  0
 14 54  1  0
 14 55  1  0
 15 56  1  0
 15 57  1  0
 17 58  1  0
 18 59  1  0
 19 60  1  0
 20 61  1  0
 22 62  1  0
 22 63  1  0
 23 64  1  0
 23 65  1  0
 24 66  1  0
 28 67  1  0
 29 68  1  0
 30 69  1  0
 31 70  1  0
 34 71  1  0
 34 72  1  0
 35 73  1  0
 35 74  1  0
 37 75  1  0
 37 76  1  0
 37 77  1  0
M  END
$$$$
