
     RDKit          3D

 79 82  0  0  0  0  0  0  0  0999 V2000
   -5.8214    3.2722   -0.1113 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7351    2.2273   -1.2202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3480    0.8272   -0.7031 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0238    0.7779    0.1083 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.6452   -0.6085    0.4193 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5674   -1.5931    0.9088 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4664   -1.2333    1.7222 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4667   -3.0358    0.5161 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5211   -3.9082    0.8526 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4742   -5.2572    0.5001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3629   -5.7476   -0.1734 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3395   -4.9126   -0.4917 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3588   -3.5858   -0.1815 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2941   -2.7743   -0.5714 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0220   -3.2544   -0.9932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1535   -2.0511   -1.3562 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2169   -2.3626   -1.2055 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0044   -1.1877   -1.3390 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5933   -0.7774    0.0221 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9345    0.6750    0.0299 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3923    0.9712    0.1273 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1933    0.4469   -1.0936 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1684   -0.6888   -0.7274 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1057   -0.3184    0.3644 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.3765    0.1918   -0.1688 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5514    0.6154    1.3798 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0241    0.5401    1.4752 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1622    1.4389    1.0444 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6781    1.5941    0.6498 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4954    2.4245   -0.6498 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9223    3.0214   -0.7702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8835    2.2340    0.0188 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6466    2.1212    1.4714 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1439    2.2222    1.7942 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8791    1.4246   -0.6474 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7465    1.1649   -1.8754 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4834    2.9182    0.7060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2310    4.2161   -0.5240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8152    3.4997    0.2933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0145    2.5676   -1.9897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7306    2.1546   -1.7128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1832    0.4539   -0.0713 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2743    0.1365   -1.5745 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1958    1.3172    1.0635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6344   -0.7959    0.5795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3987   -3.5423    1.3699 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2932   -5.9180    0.7525 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3150   -6.7893   -0.4611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1295   -3.9215   -1.8773 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5574   -3.8306   -0.1619 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3705   -1.7593   -2.4112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4361   -1.2057   -0.6892 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8336   -1.4175   -2.0385 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4609   -0.3304   -1.7967 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4653   -1.4233    0.2190 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8667   -1.0315    0.8265 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5067    2.0775    0.0743 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5155    0.1168   -1.9074 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7949    1.2799   -1.5187 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5973   -1.5818   -0.4041 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7176   -1.0093   -1.6426 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2111    1.1039   -0.7809 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8702   -0.5838   -0.7931 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0711    0.4344    0.6665 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9812    0.3558    2.3709 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8325    1.6722    1.1616 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6816    1.2222    2.2849 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7315   -0.4921    1.7636 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5814    2.4642    1.1747 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2343    0.9317    2.0351 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2585    0.5842    0.4777 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2305    3.2577   -0.6848 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6860    1.7792   -1.5313 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9115    4.0607   -0.3768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2201    3.0929   -1.8388 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2151    2.9130    2.0052 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9912    1.1343    1.8413 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1401    3.2904    1.9138 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0577    1.7032    2.7554 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  2  0
  6  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 20 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 32 35  1  0
 35 36  2  0
 35  4  1  0
 13  8  1  0
 27 21  1  0
 34 29  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
  4 44  1  1
  5 45  1  0
  9 46  1  0
 10 47  1  0
 11 48  1  0
 15 49  1  0
 15 50  1  0
 16 51  1  0
 16 52  1  0
 18 53  1  0
 18 54  1  0
 19 55  1  0
 19 56  1  0
 21 57  1  0
 22 58  1  0
 22 59  1  0
 23 60  1  0
 23 61  1  0
 25 62  1  0
 25 63  1  0
 25 64  1  0
 26 65  1  0
 26 66  1  0
 27 67  1  0
 27 68  1  0
 28 69  1  0
 28 70  1  0
 29 71  1  0
 30 72  1  0
 30 73  1  0
 31 74  1  0
 31 75  1  0
 33 76  1  0
 33 77  1  0
 34 78  1  0
 34 79  1  0
M  END
$$$$
