IBS-ZINC04957206 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 50 0 0 1 0 0 0 0 0999 V2000 1.7820 1.3760 0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8010 -0.0040 0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -0.7470 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -0.1000 -1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 1.2800 -1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 2.0170 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 1.9700 -2.4850 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3320 1.3220 -3.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 3.1880 -2.5300 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2920 -2.1480 -0.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -2.8830 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -2.4420 0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -4.3500 0.0230 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0780 -4.9180 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -4.9250 1.4200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0580 -4.1200 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -6.9490 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 -7.2140 0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 -5.8370 0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -4.3330 -0.0690 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4660 -4.8900 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -2.8600 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -2.3960 -0.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -5.8450 1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -6.8170 2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -7.6610 2.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 -7.5330 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -6.5590 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -5.7120 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2130 -8.3580 1.1910 F 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 1.9540 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -0.5050 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -0.6760 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 3.0960 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -6.8610 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -7.7410 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 -7.8720 1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 -7.6470 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 -5.8220 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 -5.6030 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -6.9170 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 -8.4210 3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6890 -6.4580 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -4.9500 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -5.6790 1.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -4.8860 1.2100 N 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 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 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 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 22 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 15 45 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 46 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 43 1 0 0 0 0 29 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END