IBS-ZINC04808446 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3850 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 1.1840 -0.6900 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 0.0140 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 1.4280 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 2.1010 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 2.1300 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 3.5230 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9400 4.1440 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1130 3.3990 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 2.0360 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 1.3660 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 0.0230 -0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -0.6650 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 -2.0440 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 -2.7020 -0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 -4.0000 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 -4.6920 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 -6.0360 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8590 -6.2970 -0.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2510 -7.1840 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5740 -5.1180 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6470 -4.0630 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0930 -2.7430 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4450 -2.4790 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3610 -3.5210 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9350 -4.8310 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5490 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 3.1810 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 4.1090 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 5.2220 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0660 3.9070 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9990 1.4720 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -2.5580 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 -4.5720 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 -6.7840 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3810 -1.9300 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7930 -1.4570 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4190 -3.3020 -0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6570 -5.6340 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 14 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 M END