
     RDKit          3D

 49 51  0  0  0  0  0  0  0  0999 V2000
   -4.5445    2.8473    0.2646 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5294    1.7684    0.0734 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6416    0.9749   -0.8993 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4473    1.6341    1.0057 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4687    0.5440    0.9423 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.0582    1.0897    1.2212 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4441    2.2224   -0.1259 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.2146    1.8901   -0.0176 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0357    2.6622    0.6795 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6233    3.7118    1.4382 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.4583    2.2692    0.5184 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2487    3.3784    0.2700 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.8965    1.6236    1.6620 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.4225    1.3130   -0.6843 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7452    2.0197   -1.8346 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.3341    0.2793   -0.5309 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.9593    0.7961   -0.7409 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.8611   -0.4563    0.0238 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6094   -1.7333   -0.5720 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2251   -2.7466   -0.1452 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5504   -1.9074   -1.6258 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0411   -0.5714   -2.1697 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4002    0.6012   -2.4928 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.4119   -2.6882   -1.1171 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1976   -2.4682    0.1712 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5310   -2.2707    1.1805 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6871   -2.6268    0.3765 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.5327   -2.3019   -0.8747 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8809   -2.1141   -0.5366 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1533   -1.8882    1.5665 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8513   -0.5249    1.9371 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9582   -0.1969    3.1501 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2268    2.9023   -0.6103 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0324    3.8251    0.3813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1410    2.6359    1.1762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4241    2.2783    1.8292 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4552    0.1216   -0.0707 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0336    1.6412    2.1854 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6537    0.2460    1.2928 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2002   -0.4535    1.0132 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0124   -2.4638   -2.4711 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4980   -0.7490   -3.1219 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3223   -0.1244   -1.4662 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1036   -3.2717   -1.8130 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8482   -3.7094    0.5781 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1664   -1.3992   -1.3989 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4495   -3.1353   -1.6089 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2439   -3.0098   -0.3096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6236   -2.4646    2.3012 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
  9 11  1  0
 11 12  1  0
 11 13  1  0
 11 14  1  0
 14 15  1  0
 14 16  1  0
 17 14  1  6
 17 18  1  0
 18 19  1  0
 19 20  2  0
 19 21  1  0
 21 22  1  0
 22 23  1  0
 21 24  1  0
 24 25  1  0
 25 26  2  0
 25 27  1  0
 27 28  1  0
 28 29  1  0
 27 30  1  0
 30 31  1  0
 31 32  2  0
 31  5  1  0
 17  8  1  0
 23 17  1  0
  1 33  1  0
  1 34  1  0
  1 35  1  0
  4 36  1  0
  5 37  1  6
  6 38  1  0
  6 39  1  0
 18 40  1  0
 21 41  1  6
 22 42  1  0
 22 43  1  0
 24 44  1  0
 27 45  1  1
 28 46  1  0
 28 47  1  0
 29 48  1  0
 30 49  1  0
M  END
$$$$
