IBS-ZINC04090757 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 0.7650 0.2620 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 0.0940 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 1.0760 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -0.8680 -0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -0.3250 0.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8750 0.3160 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -0.1730 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -1.1220 -2.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 1.1010 -1.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 1.5400 -2.8350 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6620 0.6750 -3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 2.1310 -3.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 3.0280 -3.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 1.1520 -4.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 2.5500 -5.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1860 2.6480 -2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 3.3340 -1.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 -1.7160 0.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -2.1300 1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 -1.3480 2.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -3.4690 1.8440 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -4.1860 0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -5.3960 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2450 -5.9300 0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 -5.9480 2.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 -5.4080 3.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -4.1840 3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -3.7200 4.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -4.4340 5.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -5.6320 5.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -6.1210 4.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 0.6890 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 0.9380 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -0.6960 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -1.8640 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -0.9730 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -0.4940 -0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 1.8500 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 0.9510 -3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 0.2020 -4.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 1.5680 -4.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 3.3860 -5.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 2.8830 -5.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 1.7170 -5.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -2.3750 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -3.4880 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 -4.5150 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -6.7960 2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -2.8030 4.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -4.0490 6.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -6.1850 6.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -7.0610 4.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2170 2.7040 -3.1920 O 0 5 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 4 1 0 0 0 0 2 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 53 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 M CHG 1 53 -1 M END