IBS-ZINC05164458 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.0540 1.5570 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 0.0500 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -0.7270 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -2.0680 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -2.0300 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.7450 -1.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -3.2270 -1.6290 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2030 -4.1280 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -3.3810 -2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -3.2760 -3.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -3.0580 -3.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -2.9240 -4.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -3.0290 -2.7010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -2.8360 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -1.3420 -2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 -1.1400 -2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1840 1.0110 -3.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8750 0.5140 -1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 -3.3580 -4.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -3.6010 -1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 -2.7490 -1.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 -4.8610 -0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 -5.0440 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 -6.2340 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3830 -7.1900 0.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -7.0590 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -5.8990 -0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 1.9250 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.9110 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 1.9260 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -0.3910 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -2.9530 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 -3.2330 -3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 -3.3590 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 -0.9450 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -0.8190 -3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7230 -1.5370 -3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5230 -1.6630 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7950 0.6060 -4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 0.8880 -3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4060 2.0700 -3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0490 0.0310 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5470 0.0910 -2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0610 1.5840 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -3.2600 -5.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8460 -4.2660 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1980 -6.3850 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -7.8680 -0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -5.7970 -1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4820 0.2940 -2.0640 N 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 50 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 50 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 50 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 M END