IFLAB-ZINC02722043 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 1.4000 1.4460 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -0.0590 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -0.7020 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -2.0790 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -2.8260 0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -2.1720 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -0.7930 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 -0.0850 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -4.3020 0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -4.9500 0.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -4.9310 1.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -6.3280 1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -7.1650 2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -8.4590 1.6600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -9.2740 2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -8.3680 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -7.0770 -0.0520 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0510 -6.7060 -1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -7.6270 -2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -8.9820 -2.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -9.3550 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -6.7710 3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -7.2720 4.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -6.7420 5.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -5.8240 5.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -5.5840 4.3160 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.8320 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 1.7640 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 1.8320 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -0.1230 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -2.5790 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -2.7430 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 0.1080 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 -0.7110 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 0.8600 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -4.4160 1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -5.6560 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -7.3070 -3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -9.7270 -2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -10.3980 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 -8.0220 4.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -7.0470 6.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -5.3080 6.7880 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 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 CHG 1 17 1 M END