PUBCHEM-ZINC05578411 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.4420 1.7920 -4.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 0.3830 -3.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -0.2610 -3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -1.6330 -3.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.2890 -2.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 -1.5760 -2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 -0.1950 -2.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 0.4530 -3.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8510 -2.2740 -1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 -3.4700 -1.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1170 -1.5040 -1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1480 -2.4200 -1.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3870 -2.7510 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8060 -2.3800 1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2870 -2.9000 2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3490 -3.7930 2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9370 -4.1720 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4620 -3.6540 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8230 -3.8300 -1.1020 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.0560 -3.1020 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1490 -3.0370 -3.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9080 -4.6980 -1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1570 -3.8790 -1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3550 -3.1940 -2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5000 -2.4420 -3.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4490 -2.3740 -2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2530 -3.0580 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1090 -3.8160 -0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8660 -4.6820 0.7230 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 2.1820 -4.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 1.9880 -4.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 2.2810 -3.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -2.1820 -3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -3.3550 -2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 0.3590 -2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 1.5180 -3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9200 -0.7390 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4620 -1.0310 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9790 -1.6860 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8340 -2.6110 3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7170 -4.1930 3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7630 -4.8680 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5400 -2.4730 -3.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8250 -3.5540 -3.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6240 -5.1610 -2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0960 -5.4740 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6140 -3.2460 -3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6540 -1.9070 -4.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3440 -1.7850 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9940 -3.0050 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 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 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 19 1 M END