IBS-ZINC04042899 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 -0.4750 0.4120 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 1.2690 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 2.6080 -0.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 0.6920 -1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 1.3370 -2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 0.3040 -3.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 0.5230 -5.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -0.9050 -3.4610 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -0.7710 -2.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7030 -1.3690 -1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -1.2150 -1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -0.7880 -2.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -1.1920 -2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 -2.0290 -1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 -2.4560 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -2.0430 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 -2.4410 -1.6720 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2820 -2.0940 -2.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 -3.2200 -0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 -2.1570 -4.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -2.3760 -4.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -3.6840 -5.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -3.9030 -6.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -5.2110 -7.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -5.4260 -7.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -4.6170 -7.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 2.5260 -2.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -0.6400 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 0.6070 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 0.6490 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -0.1370 -3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -0.8590 -3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 -3.1070 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.3710 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 -1.1380 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0480 -2.8670 -2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 -2.0180 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -3.4600 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 -4.1420 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4850 -2.6360 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -2.9870 -3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -2.1030 -4.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -1.5460 -5.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -2.4300 -4.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 -4.5140 -5.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -3.6300 -6.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -3.0730 -7.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -3.9570 -5.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -6.0410 -6.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -5.1570 -7.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 3.1160 -1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -6.5180 -8.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 -6.6120 -9.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 27 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 52 53 1 0 0 0 0 M END