PUBCHEM-ZINC06449731 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 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 -0.7000 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0810 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0690 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.0750 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.1720 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -4.9590 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -6.2580 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -6.2430 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -4.9970 -0.9440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -7.4530 -1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -7.4600 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -8.4410 1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -9.6440 2.2200 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8650 -9.7320 2.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -10.5450 2.5240 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5360 -4.4910 2.0340 C 0 0 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 0.0240 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6250 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6020 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 0.2730 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -0.5160 -3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 1.0190 -2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -7.7600 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -7.2070 -2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -8.2670 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -7.5380 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -8.3620 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -4.3930 2.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -5.2160 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -3.5250 1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END