IFLAB-ZINC02706153 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 -0.0740 1.5700 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 -0.6570 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2890 -1.2500 0.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5360 -1.5420 0.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9820 -1.1580 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9340 -0.5840 2.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9520 -0.0330 3.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7360 1.3260 3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7540 1.8670 4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 1.0530 5.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2020 -0.3030 5.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -0.8460 4.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 1.5840 7.1880 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.3900 -1.3190 1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5370 -2.9010 2.8230 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.2300 -2.8300 3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7520 -3.8380 3.9880 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.0200 -3.8160 4.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8040 -2.7210 4.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2270 -1.6840 3.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9520 -1.7670 2.9770 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -2.4890 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -2.4350 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -2.3340 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5540 1.9610 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5860 2.9240 4.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3840 -0.9360 6.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3640 -1.9030 4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6220 -0.5050 2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0870 -1.2980 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4390 -4.6400 4.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8420 -2.6780 4.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8110 -0.8170 3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 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 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 M END