
     RDKit          3D

 57 60  0  0  0  0  0  0  0  0999 V2000
    4.2064    2.0196   -1.6795 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8271    3.2980   -0.9420 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2763    3.1987    0.7879 S   0  0  0  0  0  6  0  0  0  0  0  0
    3.7555    4.4002    1.5252 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7754    3.1769    0.8957 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6397    1.7506    1.5025 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2713    1.3388    1.3565 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2370    2.2652    1.1613 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0411    1.8365    0.9969 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3724    0.5150    1.0083 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6287   -0.4504    1.2067 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9496   -0.0230    1.4023 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3230   -1.8973    1.1821 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6040   -2.6820    2.3095 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3651   -4.0288    2.3068 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6610   -4.8203    3.5076 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1365   -4.6416    1.1898 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3434   -5.8857    1.1805 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4230   -3.8969    0.0429 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1991   -2.5110    0.0302 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4690   -1.7258   -1.1042 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0055   -2.2282   -2.3270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3380   -1.0767   -3.2827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4175   -0.1374   -2.7105 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8143    1.0609   -1.9553 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7559    1.5440   -0.8772 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7794    2.4454   -1.2142 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7315    2.8255   -0.2624 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0071    3.9496   -0.6963 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -4.6816    2.2936    1.0284 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6754    1.3893    1.3731 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7045    1.0184    0.4357 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7040    0.1220    0.8239 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9604    2.1261   -2.7595 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6391    1.1586   -1.2696 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2964    1.8258   -1.5801 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7343    3.4667   -1.0331 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3550    4.1595   -1.4036 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3321    1.0721    1.8932 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4351    3.3270    1.1477 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7361   -0.7540    1.5474 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0095   -2.2014    3.1943 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4340   -5.5823    3.2755 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0375   -4.1868    4.3384 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2601   -5.3307    3.8581 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8113   -4.4063   -0.8279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2606   -2.8978   -2.8082 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9312   -2.8091   -2.1260 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7191   -1.5211   -4.2275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4123   -0.5121   -3.5380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0341    0.2559   -3.5471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1084   -0.7143   -2.0548 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8299    0.7999   -1.5237 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6122    1.8824   -2.6770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8460    2.8396   -2.2212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4223    2.5781    1.7652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6430    0.9812    2.3750 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  2  0
  3  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  1  0
 15 17  1  0
 17 18  2  0
 17 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  1  0
 28 30  2  0
 30 31  1  0
 31 32  2  0
 32 33  1  0
 12  7  1  0
 20 13  1  0
 32 26  1  0
 33 10  1  0
  1 34  1  0
  1 35  1  0
  1 36  1  0
  2 37  1  0
  2 38  1  0
  6 39  1  0
  8 40  1  0
 12 41  1  0
 14 42  1  0
 16 43  1  0
 16 44  1  0
 16 45  1  0
 19 46  1  0
 22 47  1  0
 22 48  1  0
 23 49  1  0
 23 50  1  0
 24 51  1  0
 24 52  1  0
 25 53  1  0
 25 54  1  0
 27 55  1  0
 30 56  1  0
 31 57  1  0
M  END
$$$$
