IBS-ZINC05274290 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.2150 -0.6640 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 1.3320 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 2.0610 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 1.9990 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 1.0480 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0350 1.8180 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1200 2.7470 -1.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 3.6980 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 2.9280 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3290 3.4080 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2100 3.1430 -0.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3790 3.7560 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6710 4.6930 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7180 4.9440 -2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5740 4.2840 -2.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9760 5.9270 -3.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0450 6.9400 -2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3100 6.1990 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9550 5.4080 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7030 5.3660 -0.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 1.9240 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -0.5620 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -1.7440 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 3.1410 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 0.3790 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 0.4650 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0770 2.3800 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8680 1.1170 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 4.2810 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0780 4.3670 -1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 2.3660 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 3.6290 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0960 3.5400 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3080 5.3880 -4.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0510 6.4560 -3.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2820 7.5760 -3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6740 7.5560 -2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6430 5.5220 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0980 6.9160 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 0.0080 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 25 1 0 0 0 0 3 42 2 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 42 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 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 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 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 20 41 1 0 0 0 0 21 22 2 0 0 0 0 M END