PUBCHEM-ZINC05553064 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 0 0 0 0 0 0999 V2000 -0.1720 1.3480 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 0.0570 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 -0.3640 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 -1.6570 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -1.9850 0.7210 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 -3.4140 0.4250 P 0 0 0 0 0 0 0 0 0 0 0 0 -4.7330 -3.7110 -1.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4980 -4.4950 1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 -4.3040 2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 -5.4990 2.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -5.3690 4.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -6.5650 4.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7860 -3.3960 1.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6940 -4.4840 1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6530 -4.2620 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7230 -3.8580 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9850 -4.0910 -3.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8270 -5.5760 -4.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1690 -6.3050 -2.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9100 -6.0660 -1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 1.6310 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 2.1680 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 1.2330 1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 0.1960 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.7340 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -0.4940 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 0.4280 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -1.5380 -1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -2.4720 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -3.3800 2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 -4.2160 3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -6.4190 2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -5.5970 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -4.4540 4.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 -5.2820 5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -6.6610 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -6.4500 5.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -7.4930 4.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1450 -5.4270 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2810 -4.5180 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5430 -4.8940 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9550 -3.2090 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7270 -2.7910 -2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7520 -4.2310 -2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5290 -3.6050 -4.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9950 -3.6210 -3.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8120 -6.0160 -4.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2290 -5.7080 -5.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1380 -7.3800 -3.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1280 -5.9720 -2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9280 -6.4700 -1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3640 -6.5210 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0160 -4.5820 -1.3660 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.0250 -4.1980 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END