PUBCHEM-ZINC05432619 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 0.5560 1.4650 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 1.3350 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 1.6910 3.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 3.5760 2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 3.2810 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 3.4970 4.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 4.9330 4.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 5.9010 4.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 5.8000 4.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 6.9810 4.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 8.2240 4.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 8.3200 4.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 7.1440 4.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 6.8810 5.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 5.5180 5.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 4.7830 5.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 7.8830 5.6430 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 7.4650 6.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 8.4990 6.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 9.5840 5.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 8.2260 7.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 9.1490 7.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 8.9130 8.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 7.7610 9.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 6.8430 8.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 7.0730 8.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5620 7.6540 9.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6380 6.4940 10.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 0.3830 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 1.9940 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 1.7750 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 1.8200 2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 0.2510 2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 1.1110 3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 1.3880 4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 4.6570 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 3.0910 2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 3.5300 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 3.8310 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 3.0150 5.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 3.2450 4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 4.8410 4.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7230 6.9280 3.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6750 9.1300 4.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 9.2960 4.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 5.4240 5.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 10.0540 6.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 9.6340 8.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 5.9370 9.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 6.3400 7.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6950 5.5840 10.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5600 6.5600 11.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7990 6.4500 11.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 1.8030 1.0640 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2220 1.2920 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 3.1300 3.5600 N 0 0 0 0 0 0 0 0 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 1 54 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 54 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 56 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 6 56 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 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 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END