CHEMBRIDGE-ZINC04955561 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 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 0.0220 -0.6640 1.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.0300 2.3470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -0.6500 3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -1.8620 3.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 0.0970 4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -0.8660 5.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -1.6080 6.7930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.7060 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0820 -1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -2.3280 -2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -1.1240 -3.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -0.1530 -2.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.9040 -4.9230 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0260 -1.8610 -5.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 0.2270 -5.3760 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 0.0110 1.0000 2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 0.7350 4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 0.7110 4.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -2.8210 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -3.2960 -3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 3 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END