IBS-ZINC00136807 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3760 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 1.2190 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 0.0390 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.4190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 2.1850 -0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7150 1.5980 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 3.4030 -0.0140 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2450 -2.1660 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -3.0160 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -4.2980 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 -4.1690 0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -4.9060 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -2.9250 0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -5.5560 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -5.5280 -0.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -6.7380 -0.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -7.9050 -0.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9020 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -0.4810 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -2.7290 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -6.7610 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -7.9350 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -8.7040 -0.1260 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 26 1 0 0 0 0 19 27 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END