IFLAB-ZINC04280291 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.6760 1.6190 -2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 0.1370 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -0.2910 -3.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -0.6000 -1.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -2.0040 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -2.8870 -2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -4.2690 -2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -4.7880 -0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -3.9090 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -2.5270 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -6.1530 -0.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -6.7290 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -8.2430 0.4040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7180 -8.5190 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -8.9800 1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -11.3040 2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -10.7920 3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -11.3620 3.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -12.6950 2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -8.7200 -0.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -8.1280 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 1.8510 -1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 1.9340 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 2.1660 -3.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -0.0750 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -2.5370 -3.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -4.9410 -2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -4.2570 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -1.8670 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -6.3830 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -6.4620 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -8.9730 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -8.5750 2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -9.8350 3.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -10.6600 2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -11.5010 4.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -12.0820 4.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -11.6720 2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -10.3920 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 -12.6710 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -13.0830 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -13.4130 2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -10.4040 1.4910 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0380 -10.2970 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -10.8550 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 43 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 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 M CHG 1 43 1 M END