IBS-ZINC04163300 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 3.8860 1.4470 3.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 1.1880 3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 1.6840 3.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 3.1390 3.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 3.9070 2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 3.4430 2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 3.6740 4.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 3.0090 4.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 5.1380 4.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 5.7630 3.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 7.1420 3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 7.8690 4.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 7.2570 5.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 5.8650 5.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 5.2900 6.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 6.0900 7.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 7.4660 7.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 8.0330 6.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 7.9200 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 9.1260 2.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2050 9.8750 1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 9.4480 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 8.2600 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 7.5090 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 10.2720 -0.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3070 9.8810 -1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 0.3760 2.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 1.6460 4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 1.9800 2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 1.3730 4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 0.1230 3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 1.4390 2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 1.1760 3.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 3.7470 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 4.9790 2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 3.9160 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 3.6550 4.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 5.1720 2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 4.2130 6.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 5.6410 8.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 8.1030 8.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 9.1130 6.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 9.4950 3.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 10.8010 2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 7.8890 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 6.5980 0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 9.8430 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 8.9240 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9300 10.6390 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 1.9370 2.7960 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2880 1.7330 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 50 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END