IBS-ZINC02261220 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 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 -2.7720 -2.3970 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -3.7690 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -4.5960 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -4.0510 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -2.6790 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -6.0920 -0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0640 -6.3310 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -6.6660 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -7.3670 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -7.6390 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -7.3800 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -6.6610 1.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -6.6040 2.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -7.2600 3.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -7.7280 2.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -7.8800 -2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -8.6210 -2.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -9.0960 -3.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -8.8390 -4.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -8.1040 -4.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -7.6290 -3.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -9.4940 -6.5440 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 -3.6390 -1.7520 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -4.1970 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -4.6980 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.2540 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -6.4970 -2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -7.9930 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -7.4010 4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -8.8220 -1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 -9.6700 -3.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -7.9050 -5.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -7.0600 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 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 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 38 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 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 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 41 1 0 0 0 0 25 42 1 0 0 0 0 M END