IBS-ZINC02454027 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 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 0.0230 -0.7000 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0810 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0680 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1710 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 -4.9760 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -6.3030 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -6.2410 0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -4.9880 0.8940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -7.3470 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -7.0300 -2.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -5.7690 -2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -4.7610 -1.9930 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -9.0320 -0.9260 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -9.8540 -2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -11.3480 -2.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -12.0500 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -13.4200 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -14.0900 -1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -13.3870 -2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -12.0150 -2.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -14.0400 -3.2010 F 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 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6250 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6020 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -7.0880 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -5.5580 -3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 -9.5740 -2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -9.5480 -3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 -11.5280 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -13.9680 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -15.1600 -1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -11.4670 -3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 40 1 0 0 0 0 M END