IBS-ZINC02213233 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.2000 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0210 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 2.0960 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 1.8400 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 0.8060 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 -0.3410 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -1.7080 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 -2.1680 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 -1.9480 -2.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7730 -2.3700 -3.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 -3.0140 -4.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 -3.2340 -3.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 -2.8160 -2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 -3.5440 -5.7270 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9630 0.8700 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4640 0.8830 1.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8320 0.9400 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3060 0.9520 2.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6540 1.0070 3.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5540 1.0510 2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0740 1.0380 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7250 0.9780 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0040 1.1110 2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4200 1.1230 3.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -1.7660 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 3.1760 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2200 -1.7290 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 -2.3700 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4290 -1.4460 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 -2.1980 -3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 -3.7360 -3.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 -2.9920 -1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3590 -0.0020 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2840 1.7770 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8410 0.8520 2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6110 0.9190 3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0220 1.0180 4.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7660 1.0720 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3540 0.9630 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8700 1.1530 1.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8110 1.1920 1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 45 46 1 0 0 0 0 M END