IBS-ZINC05197854 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 3.1510 0.7430 3.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -0.4390 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -0.9580 2.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -2.1230 1.8420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -3.0740 1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -4.1250 0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -4.2470 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -3.3330 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -2.2140 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 -1.2010 1.4980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -0.4670 3.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -1.1980 3.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 0.9800 3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 1.7090 4.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 3.1130 4.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 4.0550 4.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 3.1170 2.7640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 1.7800 2.1960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5650 1.7840 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 1.3470 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 0.6230 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 0.1960 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 0.4870 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 1.1940 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 1.6170 1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1790 1.4780 1.5300 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 4.3250 1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 4.8810 1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 6.9140 0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 6.2630 -0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 1.3200 5.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 0.8130 4.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 0.6740 2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 1.6630 2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -2.9290 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -4.8880 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -5.1080 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -3.4320 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 0.3790 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 -0.3650 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 0.1640 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 2.1580 2.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 4.1030 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 5.0700 2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 4.9880 2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 4.2260 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 6.3160 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 6.9650 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 7.9240 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 5.9310 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 5.5970 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 7.2890 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 2.1250 6.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 6.2570 0.9340 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1450 6.8460 1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 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 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 54 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 54 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 54 1 0 0 0 0 31 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END