IBS-ZINC02151148 MOE2007 3D Structure written by MMmdl. 42 44 0 0 0 0 0 0 0 0999 V2000 -0.3360 0.7620 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 1.4890 1.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 2.8420 1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 3.4230 2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 4.8140 2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 5.4690 2.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 4.8190 3.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 6.8800 2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 7.5710 2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 6.9640 1.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 5.6200 1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 5.0240 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 3.6410 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 3.0640 0.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 2.8310 -0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 5.7940 0.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 6.2900 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 9.0400 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 9.7930 3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 11.1740 3.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 11.8120 2.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 11.0790 0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 9.6970 0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 8.9800 -0.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 9.1700 4.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 2.6450 2.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -0.3080 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 1.0180 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 1.0200 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 7.4060 3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 2.2700 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 3.7860 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 2.2600 -1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 6.8140 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 5.4580 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 6.9780 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 11.7560 4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 12.8890 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 11.5870 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 8.8190 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 8.9430 4.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 2.3680 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 13 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 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 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END