OTAVA-ZINC05234105 MOE2007 3D Structure written by MMmdl. 44 47 0 0 0 0 0 0 0 0999 V2000 0.5300 7.6050 4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 8.8870 3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 9.9320 3.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 11.1090 2.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 11.2430 2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 10.1960 2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 9.0180 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 10.3250 1.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 9.8810 0.0720 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 10.3070 -0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 10.2720 -0.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 8.1190 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 7.4160 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 6.0320 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 5.3420 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 6.0570 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 7.4490 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 5.3320 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 5.9500 0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 3.8540 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 3.1630 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 1.7790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 1.0760 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 1.7470 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 3.1390 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 3.8640 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 3.2460 0.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 12.2460 2.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 7.6670 5.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 6.7700 3.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 7.4510 4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 9.8290 3.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 12.1620 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 8.2030 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6970 7.9500 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 5.4880 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 8.0040 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 3.7060 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 1.2450 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 1.1920 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 12.8930 3.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 11.8480 2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 12.8220 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 M END