CHEMBRIDGE-ZINC00290728 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7940 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.0860 0.8100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.4260 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -1.0310 -1.4290 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -3.7330 -0.9100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.7620 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -4.5450 1.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -6.1530 -0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -7.2200 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -8.5160 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -8.7590 -1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -7.7060 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -6.4050 -1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -10.1520 -1.9740 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1390 -11.0810 -1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -10.3690 -3.1730 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.4060 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -3.9060 -1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -7.0320 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -9.3430 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -7.9020 -3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -5.5840 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END