IBS-ZINC02271581 MOE2007 3D Structure written by MMmdl. 47 48 0 0 1 0 0 0 0 0999 V2000 2.0360 5.2650 -2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 5.2580 -1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 6.0350 -2.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 3.8380 -1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 3.2060 -0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.7060 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 0.9540 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 1.4740 1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 2.9960 1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 3.7100 0.3650 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5270 3.4550 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 5.8090 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 5.8420 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 6.5950 1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 7.9990 2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 7.9710 2.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 7.2240 1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 4.8050 -3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 6.2910 -2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 4.7170 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 5.7730 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 6.0600 -2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 7.0700 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 5.5860 -3.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 3.2220 -2.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 1.3180 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 1.5110 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -0.1160 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 1.0560 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 1.1980 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 0.9900 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 3.2610 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 3.3040 2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 5.2090 2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 6.3250 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1930 4.8260 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 6.0330 2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7860 6.6570 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0490 8.4820 2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 8.6070 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 7.4880 3.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6050 8.9960 2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 7.1770 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 7.7920 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 5.1890 0.5750 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5530 5.6290 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 5.4300 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 34 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 M CHG 1 45 1 M END