IBS-ZINC04860725 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -0.5390 1.3900 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 -0.0470 0.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.7160 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -0.1170 2.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -2.0520 1.3310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -2.6890 0.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -3.9840 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -4.6150 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -6.0480 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -6.2220 2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -4.9560 3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -4.0270 2.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -4.7070 4.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -5.4980 5.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -5.2520 6.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 -4.2260 6.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -3.4370 5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 -3.6710 4.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 -2.8340 3.4160 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6980 -1.8650 3.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 -3.0570 2.2300 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3990 1.8400 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 1.8050 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 1.6040 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -2.5350 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -4.5450 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -6.8100 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -7.1550 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -6.2980 5.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -5.8590 7.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -4.0400 7.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 -2.6400 5.9470 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 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 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 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END