PUBCHEM-ZINC05957712 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.8170 0.6750 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 0.9060 3.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 2.9350 1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 3.5040 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 5.0360 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 5.5410 -0.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 6.8890 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 7.8390 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 7.5210 -1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 8.4960 -2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 9.7990 -2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 10.1260 -2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 9.1670 -1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5170 8.6440 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2010 7.2920 -0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2360 6.4050 -0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5520 6.8370 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8500 8.1760 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8320 9.0590 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4280 5.8590 0.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7810 6.2510 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 11.0190 -2.8250 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -0.3940 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 0.9190 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 0.9640 -0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 1.1110 3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -0.1680 3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 1.4140 3.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 3.1510 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 3.3480 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 3.1650 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 3.1380 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7110 5.3810 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 5.4130 0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 4.9490 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 6.5020 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 8.2320 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 11.1500 -2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 5.3540 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8540 8.5710 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0790 10.1060 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2220 6.6280 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3460 5.3630 0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8660 6.9880 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 1.4280 1.7180 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6880 1.2260 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 9.5500 -1.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 45 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 47 2 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 14 47 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END