IBS-ZINC02224696 MOE2007 3D Structure written by MMmdl. 53 57 0 0 0 0 0 0 0 0999 V2000 1.4460 -8.0890 4.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -7.7640 3.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -7.1240 2.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 -6.8030 2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -7.1430 2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 -7.7810 3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -6.0940 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 -4.0850 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 -2.6640 -0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -1.8230 0.4360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -2.3390 1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -3.7600 1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -0.4790 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 0.0250 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -0.7500 -2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -0.1500 -3.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 1.2320 -3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 2.0010 -2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 1.4250 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 2.2360 -0.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 1.6680 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 0.3450 1.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 2.5450 2.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 2.0140 3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 2.8730 4.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 4.2150 4.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 4.7200 3.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 3.9430 2.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 -8.5870 5.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 -8.0110 4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -6.8880 2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 -6.9280 2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -8.0450 4.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -6.0980 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -6.6150 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -4.1010 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -4.7480 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -2.2500 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 -2.7130 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -2.3380 2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -1.7100 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -3.7700 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -4.1890 2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -1.8320 -2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -0.7590 -4.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 1.7180 -4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 3.0860 -2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 0.9420 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 2.4870 5.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 5.8050 3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 4.4270 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -4.6540 0.8520 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7600 -4.6450 1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 52 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 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 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END