cxypay0370
     RDKit          3D

 49 56  0  0  1  0  0  0  0  0999 V2000
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   -7.4138    1.4374    3.3083 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6288    0.5907    3.5851 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.7582    0.6153    1.7253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0488    0.5145    2.2657 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.4547   -0.5826   -0.0887 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.7673   -1.0671    0.6483 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.2352    0.2819   -2.1246 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.4792   -0.4072   -3.1682 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.9145   -1.3927   -1.6600 C   0  0  0  0  0  3  0  0  0  0  0  0
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    3.7429   -0.7544   -1.2447 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.3124   -1.7790   -2.7200 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.1126   -2.5123   -2.8822 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.8119   -0.4751    0.5862 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8373    0.1986   -0.1736 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0716    0.2234    0.9666 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9338    1.8961   -0.2234 C   0  0  0  0  0  3  0  0  0  0  0  0
    9.0365    2.4823    0.5574 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.2146    3.4888    0.6468 C   0  0  0  0  0  2  0  0  0  0  0  0
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   -6.4710    2.3408    3.6961 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6379    0.2213    0.6041 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8247    1.5089    2.1171 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9096    3.0808    0.1724 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3228    1.2556   -0.4688 P   0  0  0  0  0  0  0  0  0  0  0  0
    0.1579    0.7091   -1.4753 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2215    0.1014    0.0889 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5914    1.3513   -1.5115 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8647   -0.2549   -4.3564 O   0  0  0  0  0  1  0  0  0  0  0  0
   -5.5866   -0.3457    0.7118 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8547   -0.7547   -0.4206 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4442   -1.7605    0.8718 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2453   -2.4803   -2.1848 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1835   -1.8621   -1.9479 O   0  0  0  0  0  1  0  0  0  0  0  0
    3.0861   -1.9599   -1.5637 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1656   -3.6743   -4.8044 S   0  0  0  0  0  1  0  0  0  0  0  0
   -1.3033   -2.2485   -3.4831 P   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0412   -3.1626   -3.0234 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8969    1.5093   -0.6322 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9896   -0.3157    1.5818 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0504    1.5565    0.4848 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.3010    4.3838    0.7311 O   0  0  0  0  0  1  0  0  0  0  0  0
  1 28  2  0
  1 30  1  0
  2  5  2  0
  2 27  1  0
  2 28  1  0
  3  6  1  0
  3 27  1  0
  4  5  1  0
  4 30  2  0
  4 37  1  0
  5  7  1  0
  6  9  1  0
  7  9  1  0
  7 12  2  0
  8 33  1  0
 10  8  1  0
 10 15  1  0
 10 34  1  0
 11 16  1  0
 11 34  1  0
 12 37  1  0
 13 14  1  0
 13 18  1  0
 13 35  1  0
 14 19  1  0
 14 36  1  0
 15 16  1  0
 15 40  1  0
 16 41  1  0
 17 38  1  0
 17 39  2  0
 18 38  1  0
 18 42  1  0
 19 20  1  0
 19 42  1  0
 20 45  1  0
 21 22  2  0
 21 23  1  0
 21 39  1  0
 22 38  1  0
 22 46  1  0
 23 47  2  0
 23 48  1  0
 24 46  2  0
 24 48  1  0
 25 26  1  0
 25 48  1  0
 26 49  1  0
 29 32  2  0
 31 32  1  0
 32 35  1  0
 32 33  1  0
 37 11  1  0
 40 44  1  0
 43 44  1  0
 44 45  1  0
M  RAD  8   1   2   3   3   6   3   8   3   9   3  10   2  11   2  12   2
M  RAD  8  13   2  14   2  15   2  16   2  17   2  18   2  19   2  20   3
M  RAD  8  24   2  25   3  26   3  27   2  36   2  41   2  43   2  49   2
M  CHG  1  31  -1
M  END
$$$$
