IBS-ZINC02099325 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.3940 1.4300 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -0.0340 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -0.6840 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0710 2.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -2.1570 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.8920 2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -5.0220 3.4720 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6880 -4.4720 4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -6.3570 3.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -6.1060 2.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -6.1320 3.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4280 -5.8560 2.8280 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3290 -5.8170 3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0900 -5.6400 1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -5.7810 1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 -5.6100 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -5.3020 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 -5.1580 -0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8260 -5.3300 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -5.2780 4.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 -4.8480 3.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -5.9840 5.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 -6.1920 5.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -2.8130 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -4.0260 -0.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0330 -1.2240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -0.6970 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -0.0510 -2.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 1.8240 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 1.7720 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 1.7840 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -2.3880 3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -4.6820 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -6.8680 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -6.9780 4.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 -6.3400 4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -5.7200 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -5.1690 -1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7530 -4.9140 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8980 -5.2140 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -6.7290 4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2760 -5.2270 5.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 -6.7760 6.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -2.4490 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -4.2350 2.2400 N 0 0 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 27 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 24 1 0 0 0 0 6 32 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 45 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 33 45 1 0 0 0 0 M END