IFLAB-ZINC04058973 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.0070 1.5520 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 0.0900 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -0.9380 1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.1490 0.7910 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2660 -2.2010 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 -0.5660 -1.1230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -3.3640 -1.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -3.2960 -2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -4.1520 -3.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -4.0820 -4.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -3.1620 -5.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -2.3080 -4.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -2.3770 -3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -3.3660 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -3.7200 2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -3.8240 3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -0.7370 2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 0.0320 3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 0.2150 4.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -0.3620 5.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 -1.1270 4.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -1.3120 3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.9080 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 2.1180 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 1.6870 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -4.2250 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -4.8710 -2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -4.7470 -5.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 -3.1100 -6.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -1.5900 -5.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -1.7130 -2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -3.1960 2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -4.1840 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -3.8880 1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -4.0780 3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -3.6560 4.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 0.4830 3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 0.8110 5.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -0.2160 6.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -1.5760 5.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 -1.9050 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 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 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 M CHG 1 4 1 M END