IBS-ZINC02138516 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 55 0 0 1 0 0 0 0 0999 V2000 -0.3560 -2.7870 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -2.0590 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -2.7500 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -2.0820 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -0.7220 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -0.0270 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -0.6950 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 0.0070 -2.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 0.5240 -3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 0.4510 -2.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 1.2120 -4.2980 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9620 0.8030 -5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 2.7310 -4.1550 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9060 3.2020 -5.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 2.9960 -3.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 3.1400 -1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 2.9220 -2.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 2.4120 -4.1830 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0700 1.0020 -4.3200 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4130 0.4920 -5.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 0.2200 -3.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -0.1570 -2.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 2.9660 -5.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 3.2240 -6.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 3.7510 -7.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 4.0160 -7.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1130 3.7600 -6.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 3.2290 -5.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 2.8890 -4.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 2.4010 -3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 2.0270 -2.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -2.6950 -2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 -2.3520 -3.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -3.8400 -2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -3.8120 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -2.6240 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -0.2040 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 1.0350 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 3.9160 -3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 2.1560 -3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 4.1380 -1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 2.3820 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 3.5900 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 1.8840 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 3.0160 -6.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 3.9530 -8.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 4.4270 -8.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 3.9700 -6.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 2.9910 -3.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 3.2500 -3.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 50 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 30 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 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 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 M END