IBS-ZINC04729654 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.1630 1.0900 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.2840 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -0.8660 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -0.0730 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 1.3010 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 1.8830 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 -0.4230 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 -1.4440 -2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3190 -1.1830 -3.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7500 0.0990 -3.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5210 1.1210 -2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 0.8610 -1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.1360 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 0.9690 1.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5340 -0.8730 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 -0.3990 2.6350 N 0 3 0 0 0 0 0 0 0 0 0 0 6.7770 0.0270 3.4920 N 0 5 0 0 0 0 0 0 0 0 0 0 -1.1420 1.5440 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.9030 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -1.9390 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 1.9200 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 2.9560 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -1.7850 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 -2.4460 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 -1.9810 -4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 0.3030 -4.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8580 2.1230 -3.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 1.6600 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7710 -1.8540 1.2980 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 24 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 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 M CHG 1 17 1 M CHG 1 18 -1 M END