IBS-ZINC06265616 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8480 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -2.6770 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -4.0480 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -4.6030 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -3.7680 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -2.3940 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -4.3040 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -6.0770 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -7.0310 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -8.2610 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -8.0970 -0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 -8.8080 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -6.7230 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -9.5770 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -6.7630 -0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -6.6440 1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -6.7960 2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -6.6750 3.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -6.4040 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -6.2520 2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -6.3770 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -6.1780 -0.4170 Br 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 0.6070 -2.2480 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -4.6900 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 -1.7460 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 -4.4640 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -9.9000 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -10.3250 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -9.4580 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 -7.0070 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -6.7920 4.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -6.3100 4.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 -6.0400 2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 33 1 0 0 0 0 10 34 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 18 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 M END