PUBCHEM-ZINC03752693 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 1.9300 -2.5920 2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -1.6920 3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 -0.9290 2.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -1.0700 0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -1.9720 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -2.7310 1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 -0.3650 -0.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 0.3950 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 1.7740 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 2.5910 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8730 1.9710 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0400 0.5970 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 -0.2100 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4510 0.3270 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1020 1.5460 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1300 2.5160 0.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3170 3.5010 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5290 1.8800 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3390 1.5460 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7030 1.8420 -0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2810 2.4810 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4930 2.8240 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1250 2.5260 1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2260 2.9710 2.7420 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.0820 -1.0270 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9860 -1.5590 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9100 -1.1950 -2.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 -3.1840 3.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -1.5830 4.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 -0.2320 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 -2.0840 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -3.4290 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 2.2190 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5190 3.6650 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 -1.2820 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9080 1.0430 -1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3110 1.5660 -1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3430 2.7080 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9530 3.3180 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1340 -1.0040 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 -1.7240 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0130 -2.3390 -1.7580 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 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 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 M CHG 1 42 -1 M END