PUBCHEM-ZINC03204393 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 -1.9260 1.8340 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 0.4100 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.5740 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -0.1760 0.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -1.8980 0.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -2.8710 0.3350 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6800 -3.5110 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -3.7270 -0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -4.1550 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -5.2290 -2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -6.1620 -2.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -7.0570 -3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -7.0460 -3.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 -6.1340 -2.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -5.2130 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 -4.1990 -1.3830 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -3.9580 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 -3.5730 -0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -2.4060 0.1180 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6330 -1.6230 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -2.8670 1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -3.9400 2.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -4.3630 3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 -3.7130 3.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8940 -2.6400 3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4700 -2.2140 2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0100 -1.9440 4.0380 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.3830 -2.3170 5.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5570 -0.9990 3.4980 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8080 -2.1400 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -1.7490 -0.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 2.5460 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 1.9490 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 2.0210 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 0.2230 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 0.2960 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -3.1420 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -4.6080 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -6.1780 -2.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -7.7930 -4.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 -7.7740 -4.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 -6.1350 -2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -4.4480 1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 -5.2010 3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -4.0440 4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9520 -1.3740 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -1.9240 1.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 -1.4510 1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 30 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 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 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 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 22 43 1 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 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 30 31 2 0 0 0 0 30 47 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END