
     RDKit          3D

 68 70  0  0  0  0  0  0  0  0999 V2000
    9.7039   -0.9430   -0.7184 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3799   -0.4809   -0.2158 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2211   -1.1348   -0.4452 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1612   -0.5300    0.1578 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8007   -1.0895    0.0074 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7208   -0.5925    0.6262 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3670   -1.1653    0.4333 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2363   -2.2404   -0.2164 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1951   -0.5388    1.0046 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1535    0.9031    1.3137 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4239    1.7656    0.0674 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2962    3.2741    0.3778 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0847    3.9279   -0.2918 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1122    3.3320    0.1669 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2160    4.1385   -0.1966 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5176    3.3134   -0.1450 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6286    4.1730   -0.2412 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5533    2.1976   -1.2473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6479    2.3758   -2.1169 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5684    0.7540   -0.6658 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7495   -0.1782   -1.7037 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2854    0.4268    0.1305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1736   -1.0091    0.4188 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2076   -1.6687    1.1798 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7885   -1.0449    2.1118 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6267   -3.0547    0.8679 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1464   -3.8813    1.8796 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5535   -5.1867    1.5870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4538   -5.6753    0.2813 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8489   -6.9416   -0.0007 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9573   -4.8547   -0.7354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5452   -3.5502   -0.4465 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8773   -1.6743    0.2186 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0648   -1.3943    1.4028 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4866    0.6204    0.8851 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1445    0.8658    0.7574 S   0  0  0  0  0  0  0  0  0  0  0  0
   10.2962   -1.3510    0.1262 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2512   -0.0895   -1.1715 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5691   -1.7333   -1.4869 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6929   -1.9486   -0.6451 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8271    0.2508    1.2904 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8955    1.1339    2.1059 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1575    1.1808    1.7188 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4558    1.5749   -0.2963 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7432    1.4640   -0.7561 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2086    3.7928    0.0091 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2482    3.4618    1.4734 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1719    3.8056   -1.3955 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1159    5.0165   -0.0477 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1109    4.5657   -1.2244 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3000    4.9808    0.5251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5746    2.8500    0.8625 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5327    4.6992   -1.0782 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6403    2.2803   -1.8792 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4757    2.1780   -1.6032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4385    0.6640    0.0218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9634   -0.1128   -2.3054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4113    0.7569   -0.4617 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2721    0.9868    1.0886 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2267   -3.5226    2.8973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9400   -5.8199    2.3755 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8872   -5.2299   -1.7489 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1736   -2.9251   -1.2501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0151   -2.7720    0.1266 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4259   -1.3416   -0.7422 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4531   -2.3574    1.8023 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4916   -0.9349    2.2491 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8109    1.2570    1.4363 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  1  0
  5  6  2  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  1  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 20 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  2  0
 24 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 29 31  1  0
 31 32  2  0
 23 33  1  0
 33 34  1  0
  4 35  2  0
 35 36  1  0
 36  2  1  0
 34  9  1  0
 32 26  1  0
  1 37  1  0
  1 38  1  0
  1 39  1  0
  5 40  1  0
  6 41  1  0
 10 42  1  0
 10 43  1  0
 11 44  1  0
 11 45  1  0
 12 46  1  0
 12 47  1  0
 13 48  1  0
 13 49  1  0
 15 50  1  0
 15 51  1  0
 16 52  1  0
 17 53  1  0
 18 54  1  0
 19 55  1  0
 20 56  1  0
 21 57  1  0
 22 58  1  0
 22 59  1  0
 27 60  1  0
 28 61  1  0
 31 62  1  0
 32 63  1  0
 33 64  1  0
 33 65  1  0
 34 66  1  0
 34 67  1  0
 35 68  1  0
M  END
$$$$
