PUBCHEM-ZINC04521360 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3760 -0.5120 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -1.9610 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -2.2460 -1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -0.1960 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -0.6570 2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -0.3410 3.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 0.4340 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 0.8940 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 0.5870 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 1.0860 -0.0810 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7160 1.7720 -0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 0.8110 -1.1280 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.9730 0.7710 4.8580 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.9820 1.4520 4.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 0.3660 5.9160 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6470 -0.7900 4.7780 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -2.4630 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -2.3290 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -1.7440 -2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -1.8780 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -3.3200 -1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -1.2620 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6970 1.4980 2.3800 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 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M CHG 1 15 1 M CHG 1 17 -1 M END