IBS-ZINC04041733 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.1460 0.8940 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 0.7130 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 2.8580 1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 3.3890 2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 4.8400 2.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 5.8440 1.5360 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3900 5.7420 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 7.1950 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 8.4300 1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 8.5250 0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4650 7.8220 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 7.9130 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 8.6990 -1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9710 9.4010 -1.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 9.3220 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 10.1690 -2.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 10.2090 -3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 9.5510 2.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 6.9410 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 7.7810 3.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 5.4660 3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 4.9100 4.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 5.6800 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 5.3130 -0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 5.1660 -2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 5.3940 -2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 5.7580 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 5.8940 -0.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.1840 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 1.1140 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 1.3730 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 0.8700 2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 -0.3540 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 1.1110 3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 3.3370 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 3.0800 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 3.1560 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 2.9190 3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 7.2070 1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3360 7.3700 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9040 8.7660 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 9.8720 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4530 10.8570 -4.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 9.2030 -4.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6830 10.5970 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 10.3670 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 5.1430 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0330 4.8790 -2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 5.2880 -3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 5.9380 -1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 1.4050 1.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 51 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 18 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 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 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 24 47 1 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 M END