IBS-ZINC04306122 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 0.3920 1.7980 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 0.3190 -2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -0.4640 -1.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -1.8100 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -2.6290 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -3.9960 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -4.5510 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -3.7300 -2.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -2.3640 -2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -5.9370 -1.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -6.7930 -0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -8.1660 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -8.9860 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -8.4340 1.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -7.1220 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -6.3110 0.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -6.5850 2.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -7.4640 3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -6.6240 4.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 -5.9990 3.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -10.3600 0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -8.7410 -2.1290 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7510 -8.8830 -2.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -9.0730 -3.1020 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4160 1.9480 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 2.1050 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 2.3960 -2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 0.0120 -2.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 0.1690 -3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -2.1980 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -4.6340 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -4.1610 -3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -1.7260 -3.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -6.2990 -2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -5.6260 2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 -8.1710 2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -8.0110 3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 -7.2670 5.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -5.8590 4.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 -5.4490 4.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -10.7550 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -10.9250 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 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 22 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END