IBS-ZINC02100168 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.9350 -1.6200 -2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.4410 -2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 0.8150 -2.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -0.1630 -1.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -0.7570 -1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 -1.8000 -2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -2.3130 -1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 -1.7800 -0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 -0.7530 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -0.2470 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8580 -2.3460 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0800 -3.5210 -0.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7760 -1.4640 0.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1360 -1.8060 0.5530 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5270 -2.6040 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1830 -2.1850 2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6290 -3.5470 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3650 -3.8340 2.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2490 -5.1920 2.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 -5.6790 3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 -5.8050 2.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3100 -4.7970 2.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6020 -5.1630 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9610 -6.5160 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0550 -7.5000 2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7670 -7.1630 2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0500 -0.5560 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4150 0.5440 0.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -2.5290 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -1.4260 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -1.8200 -3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -0.6260 -3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 1.0790 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 1.6700 -3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 0.6830 -3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -2.2470 -2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 -3.1260 -2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 -0.3470 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 0.5530 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5900 -0.4650 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2140 -2.1600 2.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6310 -1.4420 2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5360 -3.1850 3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3110 -4.4020 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9560 -6.7980 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3510 -8.5450 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0590 -7.9290 2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2910 -0.7820 0.4330 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 39 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 40 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 M CHG 1 48 -1 M END