PUBCHEM-ZINC05877364 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -0.7020 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 -1.1470 -2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -1.3860 -3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -1.1740 -3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -0.7280 -2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -1.4060 -4.6850 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -1.2090 -4.7070 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -1.4410 -5.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -1.8920 -7.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -2.1250 -8.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 -1.9130 -8.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 -1.4660 -7.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -1.2340 -5.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5990 -1.2420 -7.0710 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.1760 -0.8490 -6.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2260 -1.4500 -8.0940 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.3800 -2.2080 -9.6320 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -1.8240 -4.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 -0.5160 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 -1.3090 -2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -0.5660 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -2.0570 -6.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -2.4730 -9.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -0.8910 -4.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -2.7870 -4.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 21 33 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END