IFLAB-ZINC04248465 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.1850 -0.6750 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -2.0800 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.7630 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -2.1030 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -0.7320 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -0.3550 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 -1.4390 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -2.5360 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7610 -1.4380 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -0.6160 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7180 -0.6150 1.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3780 0.0500 2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7570 0.6500 3.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8540 0.0510 2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5400 0.7400 3.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9160 0.7380 3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6240 0.0520 2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9460 -0.6360 1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5690 -0.6330 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9810 0.0520 2.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.6450 -0.6740 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -0.1300 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -2.6150 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -3.8430 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -3.5640 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -0.9990 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 -2.4620 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 -1.0550 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 0.4080 1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2140 -1.0940 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9900 1.2730 4.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4470 1.2700 4.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4990 -1.1680 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0430 -1.1630 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7240 -0.5920 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3670 -0.2600 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3520 -1.7220 1.3360 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 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 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 17 36 1 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 22 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END