IBS-ZINC02253455 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 56 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3900 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 1.1780 -0.6880 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0150 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4320 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 2.1040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 2.1260 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 1.4810 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0330 1.8840 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8020 0.7700 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 -0.3580 -0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6930 0.0130 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 -0.6510 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5180 -1.7360 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7020 -2.2160 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 -2.8420 2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8230 -3.2850 3.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0330 -3.1010 3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0840 -2.4700 3.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9150 -2.0340 1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1570 -2.4100 4.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8860 -3.3730 5.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4480 -3.4370 5.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1850 0.7700 -0.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6190 3.5460 -0.0410 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9260 3.5130 -0.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 4.3430 -0.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8080 4.0290 1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0120 3.8200 2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1620 4.1990 3.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1060 4.7870 4.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 4.9960 3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7550 4.6210 2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2510 5.1580 5.5770 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 1.9100 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 1.1760 -1.7680 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 3.1840 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8000 -2.3770 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4740 -1.7730 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 -2.9860 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0060 -3.7740 3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7290 -1.5480 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3060 -4.3440 4.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2800 -3.0280 6.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6710 1.6090 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6700 -0.0710 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8350 3.3610 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1020 4.0350 4.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0760 5.4550 4.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8160 4.7880 1.8070 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 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 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 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 33 51 1 0 0 0 0 M END