IBS-ZINC00178379 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 0.0120 1.5000 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 0.0520 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -0.7460 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.3670 2.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -2.2110 0.6530 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9950 -2.6800 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -2.0480 -0.7800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -0.7220 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -0.2520 -2.7550 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -2.9550 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -4.4240 0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 -5.2450 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 -4.6290 1.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 1.8970 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 1.8560 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 1.8540 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -2.8130 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -2.8860 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -2.4700 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -4.5030 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -4.9030 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -6.4620 0.8410 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 8 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 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 M CHG 1 22 -1 M END