
     RDKit          3D

 64 66  0  0  0  0  0  0  0  0999 V2000
    4.1745   -0.4941    2.5702 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1676    0.7070    1.6834 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9456    1.7821    1.9801 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9649    2.8735    1.1698 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1883    2.8972    0.0121 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3983    1.7761   -0.2927 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5235    1.7662   -1.4876 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6282    2.6979   -2.3342 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5212    0.7451   -1.6872 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9614   -0.6514   -1.8726 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7964   -1.4957   -0.5891 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0777   -2.8377   -0.8298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4531   -2.7016   -0.8955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0241   -2.4391    0.4290 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4314   -2.5446    0.6846 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8216   -2.8736    1.8399 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4392   -2.2746   -0.3620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3964   -3.2629   -0.6457 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3401   -3.0673   -1.6593 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5245   -4.3161   -2.0117 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -5.3360   -1.8799   -2.3978 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4031   -0.8818   -2.1112 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4669   -1.0555   -1.0834 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5732   -0.0094   -0.8258 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4720    0.6616    0.4273 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1051    1.3694    0.5133 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8069    1.9535    1.9272 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8380    0.8809    3.0342 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5684    2.6455    1.9509 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0677    2.4477   -0.4858 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3395    2.3984   -1.7291 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1938    3.4636   -2.3902 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2324    1.1202   -2.2961 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4112    0.7114    0.5536 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1606   -0.9546    2.5934 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9092   -1.2307    2.1874 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4601   -0.2115    3.6042 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5824    3.7251    1.4255 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1943    3.7773   -0.6223 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0270   -0.6732   -2.1931 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4005   -1.1115   -2.7167 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2872   -0.9280    0.2145 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8110   -1.7321   -0.2031 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3407   -3.5398   -0.0077 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4473   -3.3015   -1.7707 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7413   -1.8972   -1.6008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8719   -3.6577   -1.2822 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3913   -2.3642    1.2602 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3973   -4.1952   -0.0938 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0590   -1.7244   -3.1892 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4148    0.0416   -2.6769 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2938    1.4036    0.5117 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5847   -0.0635    1.2489 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3212    0.6186    0.2929 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5761    2.7175    2.1684 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8784    0.5510    3.2457 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4378    1.2897    3.9872 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2203   -0.0002    2.7465 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6580    3.3984    1.1388 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7157    3.1802    2.9169 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3745    1.8955    1.8378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5746    3.3325   -0.2605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5048    0.3088   -2.1580 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3722    1.2334   -3.3938 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  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
 27 29  1  0
 26 30  1  0
 30 31  1  0
 31 32  2  0
 31 33  1  0
  6 34  2  0
 34  2  1  0
 33  9  1  0
 23 17  1  0
  1 35  1  0
  1 36  1  0
  1 37  1  0
  4 38  1  0
  5 39  1  0
 10 40  1  0
 10 41  1  0
 11 42  1  0
 11 43  1  0
 12 44  1  0
 12 45  1  0
 13 46  1  0
 13 47  1  0
 14 48  1  0
 18 49  1  0
 21 50  1  0
 22 51  1  0
 25 52  1  0
 25 53  1  0
 26 54  1  0
 27 55  1  0
 28 56  1  0
 28 57  1  0
 28 58  1  0
 29 59  1  0
 29 60  1  0
 29 61  1  0
 30 62  1  0
 33 63  1  0
 33 64  1  0
M  END
$$$$
