
     RDKit          3D

 69 70  0  0  0  0  0  0  0  0999 V2000
   -6.4949    0.5094    1.1241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0964    0.3557    1.2364 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4332    0.8771    0.0943 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2115    1.7006    0.5771 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4164    2.2461   -0.5402 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8503    3.4137   -1.2734 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8187    4.3973   -0.6890 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3965    3.6314   -2.4292 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1483    1.5959   -0.9092 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0508    2.3929   -0.3921 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3733    1.6891   -0.7204 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4922    0.4269    0.0541 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4922    0.5234    1.1468 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9179    0.3559    0.6819 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3643    1.0811   -0.2485 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7819   -0.5749    1.3518 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0735   -0.9603    0.8545 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3000   -1.1501   -0.5211 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5598   -1.5504   -0.9774 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5981   -1.7707   -0.0683 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3770   -1.6007    1.3009 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1165   -1.2078    1.7619 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6453   -0.7580   -0.8285 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5889   -2.1034   -0.0725 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2889   -2.3197    0.7230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8854   -2.7555   -0.1694 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0500   -2.9784    0.6114 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8021   -1.7848    0.7505 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8920   -1.6905   -0.3413 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1104   -2.1945    0.1435 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0929   -0.2656   -0.9263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1184   -0.3423   -1.8863 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9751    0.0036    1.9869 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8819    0.0354    0.1947 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7749    1.5865    1.1591 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0627    1.6254   -0.4465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5707    1.1124    1.2608 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5748    2.5319    1.2164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4557    4.7376    0.3028 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9082    5.2886   -1.3470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8209    3.9382   -0.5794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0983    0.5777   -0.4836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0849    1.4785   -2.0125 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0535    3.3987   -0.8636 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0343    2.5298    0.7084 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4301    1.5147   -1.8203 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1990    2.3987   -0.4909 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4002    1.5008    1.6690 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2550   -0.2378    1.9183 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4959   -0.9267    2.2929 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5008   -1.0177   -1.2379 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7294   -1.6977   -2.0362 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5716   -2.0804   -0.4255 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1809   -1.7797    2.0049 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9541   -1.0863    2.8265 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6030   -0.7013   -1.3917 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8321   -0.7580   -1.5878 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7196   -2.9311   -0.8042 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4523   -2.1760    0.6200 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0326   -1.4010    1.2905 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4671   -3.1230    1.4706 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0578   -2.0258   -0.9941 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6177   -3.7173   -0.6567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2860   -1.7941    1.7511 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1505   -0.8995    0.7581 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5710   -2.3215   -1.2030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0010   -3.1777    0.2262 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1548   -0.0207   -1.4646 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9992    0.4255   -2.5064 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  1  0
  5  6  1  0
  6  7  1  0
  6  8  2  0
  5  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  2  0
 14 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  2  0
 12 23  1  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
 29 30  1  0
 29 31  1  0
 31 32  1  0
 31  3  1  0
 22 17  1  0
  1 33  1  0
  1 34  1  0
  1 35  1  0
  3 36  1  0
  4 37  1  0
  4 38  1  0
  7 39  1  0
  7 40  1  0
  7 41  1  0
  9 42  1  0
  9 43  1  0
 10 44  1  0
 10 45  1  0
 11 46  1  0
 11 47  1  0
 13 48  1  0
 13 49  1  0
 16 50  1  0
 18 51  1  0
 19 52  1  0
 20 53  1  0
 21 54  1  0
 22 55  1  0
 23 56  1  0
 23 57  1  0
 24 58  1  0
 24 59  1  0
 25 60  1  0
 25 61  1  0
 26 62  1  0
 26 63  1  0
 28 64  1  0
 28 65  1  0
 29 66  1  0
 30 67  1  0
 31 68  1  0
 32 69  1  0
M  END
$$$$
