IBS-ZINC02340790 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 1 0 0 0 0 0999 V2000 2.1370 1.9490 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 0.4730 1.0230 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9260 0.4540 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -0.2800 1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 -0.5480 0.7740 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5830 0.4110 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -1.2470 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -0.2280 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 -1.0000 -2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 0.0080 -3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 1.3370 -3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 2.2710 -4.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 1.8900 -5.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.5840 -5.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -0.3400 -4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -1.5810 -4.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -1.4740 -5.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -2.5240 -5.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 -2.6380 -6.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 -2.1030 -7.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 -2.4650 -8.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 -2.1920 -9.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7750 -3.2610 -7.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 -3.3930 -6.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6200 -4.1740 -5.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8630 -4.7890 -5.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5500 -4.6360 -6.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0200 -3.8670 -7.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -0.0950 -5.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 0.4230 -6.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0280 1.7160 -2.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1880 -1.3840 1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 2.0840 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 2.4730 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 2.4430 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 0.2790 2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -1.2370 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 -1.3300 -1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 -2.2450 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -1.2170 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 0.3660 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -1.8610 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -1.3580 -3.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 3.2970 -4.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 2.5920 -5.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -3.4320 -5.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -1.4890 -8.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0990 -4.2990 -4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2950 -5.3900 -4.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5150 -5.1200 -7.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5590 -3.7500 -8.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 2.6240 -2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 -2.3630 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 -1.5490 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 -0.8760 2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -0.4380 -1.1680 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9760 0.4940 -1.4070 H 0 0 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 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 32 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 56 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 8 56 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 9 56 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END