NCID-ZINC04522193 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0250 1.3850 -0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 0.0080 -0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -0.6690 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 0.0290 -0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 1.4060 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 2.0970 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 3.4620 -0.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 4.1160 -0.2710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 5.4750 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 6.1850 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 7.5390 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 8.2590 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 9.6610 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 10.3400 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 9.6680 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 8.2900 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 7.5620 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 6.1580 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 5.4760 -0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 7.6250 0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 12.0990 0.2060 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 12.4810 0.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 12.4600 0.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 5.3030 -0.3040 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 5.1610 1.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 4.1990 -1.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -2.4280 -0.5910 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -2.8480 -0.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.8690 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -2.8310 -2.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -2.4980 -3.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 -2.7660 -4.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 -2.3740 -4.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2520 -1.7460 -4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -1.6680 -2.5400 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 1.9130 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -0.5430 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 -0.5060 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 1.9500 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 8.0680 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 10.2010 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 10.2290 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 5.2300 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 8.0630 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 6.7230 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -3.3000 -2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.5470 -5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 -1.3500 -4.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 12.6280 -1.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0050 6.2040 -1.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8820 5.8120 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 13.5940 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 50 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 46 1 0 0 0 0 31 32 2 0 0 0 0 31 35 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 47 1 0 0 0 0 34 35 1 0 0 0 0 34 48 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 M END