IBS-ZINC04744652 MOE2007 3D Structure written by MMmdl. 38 41 0 0 0 0 0 0 0 0999 V2000 -0.2120 6.1910 4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 5.0190 3.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 4.9250 2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 3.8270 1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 2.8040 1.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 2.8650 3.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 3.9810 3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 1.6880 2.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 0.9430 1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 1.6200 1.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 1.1240 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 1.3110 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 -0.2350 1.4950 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 -0.6540 2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 -1.8640 2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 -2.3610 2.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2370 -1.6350 3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 -0.4200 4.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 0.0870 3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 1.2640 3.7990 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 5.9840 5.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 7.0950 4.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 6.4020 4.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 5.7180 2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 3.7850 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 4.0300 4.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 0.0640 0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 1.6400 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 0.8120 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 2.3710 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 1.1650 -2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 -2.4380 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3010 -3.3100 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0320 -2.0100 4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 0.1450 5.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -0.2870 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 0.7260 -2.3890 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8150 0.8530 -3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 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 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 20 2 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 31 37 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 37 1 M END