PUBCHEM-ZINC03678846 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 0.0680 1.3250 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -0.0910 -0.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -0.5520 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 0.1220 2.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -2.0640 1.1330 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3810 -2.5180 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -2.5170 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -3.9520 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -4.8680 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 -4.7820 -1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 -5.9160 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 -7.1210 -1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -7.2300 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -6.0890 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -5.9160 1.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -6.6520 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 -4.6190 1.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -4.0430 2.7450 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1840 -4.3340 2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -4.4750 4.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -5.4570 4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -5.8890 6.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -5.3620 6.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -4.4080 5.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -3.9730 4.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 -2.8010 3.9190 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -6.2160 4.2350 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 1.8470 0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 1.5800 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 1.6350 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -2.3650 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 -1.9070 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 -3.8500 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -5.8530 -3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 -7.9900 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 -8.1700 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -6.6460 6.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -5.7020 7.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 -4.0090 6.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -2.5390 2.5780 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6970 -2.1390 2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -2.1260 3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 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 7 1 0 0 0 0 5 40 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 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 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 M CHG 1 40 1 M END