IFLAB-ZINC04940858 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7430 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -0.9090 1.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -2.0160 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 -2.1680 1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -1.2140 2.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -0.1070 3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 0.0430 2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8240 -1.4370 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -2.0810 -1.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 0.0680 -2.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -1.0250 -1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -1.7780 -3.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 -1.9390 -3.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -2.5780 -4.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -3.0190 -5.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0950 -2.7410 -4.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4710 -3.4010 -6.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8080 -3.5500 -6.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 -3.0460 -5.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4100 -2.3900 -4.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 -2.2300 -4.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -1.7250 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.1920 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -2.7620 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 -3.0330 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9780 -1.3320 3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 0.6390 3.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 0.9060 2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -0.0430 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -1.5900 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -2.7590 -3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -1.2130 -3.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 -1.5870 -2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 -3.7950 -6.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1000 -4.0600 -7.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8210 -3.1660 -5.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1700 -2.0000 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7920 -1.7140 -3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 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 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 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 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 M END