IBS-ZINC02355461 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.3030 2.7580 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 1.7250 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 0.9640 1.2300 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6060 1.6960 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 0.1900 2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -0.0080 0.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0840 -0.6420 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -0.9200 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 -0.5060 0.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 -2.2110 -0.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -2.5410 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 -3.2420 -0.3220 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6810 -3.1100 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 -3.0780 -1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2210 -2.9550 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9590 -2.7890 -2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3110 -2.7440 -3.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 -2.8670 -4.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 -3.0360 -2.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -4.6780 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -4.7410 -0.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 0.6380 -1.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 0.1160 -2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -0.8580 -2.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 0.8060 -3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 0.3980 -4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 1.1000 -6.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 2.1980 -5.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 2.5920 -4.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 1.8950 -3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 2.3260 -2.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 1.7170 -1.2870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 3.3620 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 2.2910 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 3.4370 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 1.0100 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 2.2550 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 0.8620 3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -0.2790 2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -0.5940 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7390 -2.9850 -0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0400 -2.6960 -2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8860 -2.6150 -4.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4160 -2.8360 -4.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1020 -3.1350 -2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -0.4590 -4.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 0.7950 -6.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 2.7500 -6.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 3.4500 -4.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2170 -5.5970 0.0920 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 50 1 0 0 0 0 22 23 1 0 0 0 0 22 32 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 M CHG 1 50 -1 M END