
     RDKit          3D

 44 46  0  0  0  0  0  0  0  0999 V2000
    5.5270    0.7563    1.2545 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1592    0.4770    0.9834 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7166    0.0173   -0.2603 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5384   -0.1978   -1.1939 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2529   -0.2488   -0.4699 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.9967   -1.7639   -0.5853 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6051   -2.1185   -0.1555 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4964   -2.2632   -0.9725 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5397   -2.5812   -0.1864 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0660   -2.5885    1.0750 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2524   -2.3103    1.1331 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9313   -2.7606   -0.5912 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6672   -1.4616   -0.4487 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5693   -0.5111   -1.3855 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1362    0.8628   -1.1697 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5771    1.4705   -0.0025 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2287    1.8344    0.1594 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8454    2.4488    1.3566 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5195    2.8407    1.5618 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4468    2.6080    0.5774 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0978    3.1467    0.8615 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0806    1.9626   -0.6178 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2562    1.6027   -0.8314 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0624    1.6699   -1.6728 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1759    2.4714   -2.6378 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8060    0.4427   -1.6846 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8948    1.5512    0.5716 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1360   -0.1632    1.1238 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6263    1.1080    2.3018 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7122    0.1369    0.4210 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1766   -2.1159   -1.6247 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6990   -2.3208    0.0741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5366   -2.1385   -2.0471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6749   -2.7819    1.9488 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9855   -3.1306   -1.6389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4107   -3.5228    0.0600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2038   -1.2628    0.4751 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0182   -0.7087   -2.3011 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2365    0.7857   -1.0427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9395    1.5010   -2.0577 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5820    2.6332    2.1283 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2447    3.3292    2.4880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5237    1.1454   -1.7731 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2265    0.1485   -2.5958 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  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
  9 12  1  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 20 22  1  0
 22 23  2  0
 22 24  1  0
 24 25  2  0
 24 26  1  0
 26  5  1  0
 11  7  1  0
 23 17  1  0
  1 27  1  0
  1 28  1  0
  1 29  1  0
  5 30  1  1
  6 31  1  0
  6 32  1  0
  8 33  1  0
 10 34  1  0
 12 35  1  0
 12 36  1  0
 13 37  1  0
 14 38  1  0
 15 39  1  0
 15 40  1  0
 18 41  1  0
 19 42  1  0
 23 43  1  0
 26 44  1  0
M  END
$$$$
