IBS-ZINC05164730 MOE2007 3D Structure written by MMmdl. 47 50 0 0 0 0 0 0 0 0999 V2000 -4.7690 3.3200 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2710 3.4030 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 4.6490 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 4.7570 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 3.5700 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 2.3100 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 2.2270 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 1.3510 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0340 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 3.3740 0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 4.1220 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 1.3410 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -0.0120 0.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -0.5930 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 0.0010 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 1.9800 0.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7970 1.1700 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 2.0500 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6610 0.4160 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8920 -0.4390 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0810 0.4030 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7180 1.2680 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4870 2.1200 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1580 3.2940 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2000 4.1820 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1030 2.4220 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 5.5610 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 5.7280 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 1.2510 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -1.6780 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 2.9880 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 0.5560 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 0.4970 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0080 2.7290 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1490 2.6500 1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8210 1.1160 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8060 -0.2270 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6620 -1.1830 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1560 -0.9940 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9240 -0.2500 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4090 1.0430 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5350 0.6270 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5640 1.9170 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1890 2.6570 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6570 2.8360 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3290 1.2310 0.0270 N 0 3 0 0 0 0 0 0 0 0 0 0 7.1780 0.5720 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 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 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END