IBS-ZINC03983787 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 1 0 0 0 0 0999 V2000 -0.2840 1.1670 0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -0.1730 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.6640 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 0.1780 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 1.5260 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 2.0170 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -0.3800 0.0970 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6520 -1.4650 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 -0.1600 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0380 -0.4530 0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 0.0360 -0.7100 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 0.2290 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8840 0.3750 -1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6560 1.1020 -2.6790 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8820 1.4080 -3.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8880 0.8400 -2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2450 0.0710 -1.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8950 -0.8620 -0.5860 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1210 -1.4340 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9310 -1.8630 -1.1840 C 0 0 3 0 0 0 0 0 0 0 0 0 10.5700 -1.3370 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8080 -2.1090 0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8180 -2.4600 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7820 -0.7830 0.8040 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7540 -0.9160 1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5640 -0.0920 0.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9430 0.1340 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7420 1.4110 1.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7970 1.6070 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1820 -3.1280 0.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6530 -3.5740 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3470 -3.0130 -1.5170 O 0 5 0 0 0 0 0 0 0 0 0 0 10.2260 0.9840 -2.6160 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5250 1.7260 -3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6100 2.3390 -4.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2330 2.2350 -4.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4370 2.7970 -5.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 1.5500 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.8370 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -1.7140 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 2.2100 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 3.0640 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 0.8750 1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 -0.8160 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8280 0.0540 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2030 -1.5350 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2510 -0.2830 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 1.2990 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8990 -0.2710 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0010 0.2950 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5730 1.9260 -3.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9270 2.8990 -5.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 38 1 0 0 0 0 2 3 2 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 34 51 1 0 0 0 0 35 36 1 0 0 0 0 35 52 1 0 0 0 0 36 37 2 0 0 0 0 M CHG 1 32 -1 M END