PUBCHEM-ZINC03013855 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 0.0380 2.1240 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 0.7450 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -0.0010 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 0.6320 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 2.0120 -0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 2.7580 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 -0.1810 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0580 -0.5060 -1.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1840 -1.2340 -1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7930 -1.5880 -0.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 -1.5700 -2.8860 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8590 -2.3630 -3.0240 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1140 -2.8070 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 -3.4710 -4.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2130 -2.7360 -5.6460 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.1430 -4.4470 -4.2240 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 -4.5370 -3.5080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.9540 -1.4970 -3.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9080 -1.1160 -2.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8400 -1.6440 -0.9680 S 0 0 0 0 0 0 0 0 0 0 0 0 10.8400 0.1700 -2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1930 0.2020 -2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1030 0.6910 -1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6690 1.1490 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3230 1.1190 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4080 0.6310 -0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8640 1.6090 1.3920 N 0 3 0 0 0 0 0 0 0 0 0 0 11.6700 2.0390 2.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6780 1.5830 1.6720 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8700 2.7060 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 0.2500 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -1.0790 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 2.5070 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 3.8350 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 0.3960 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -1.1010 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1480 -1.2880 -3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9920 -1.1970 -4.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5320 -0.1560 -3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1540 0.7160 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3830 1.5300 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3570 0.6090 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9150 -0.3190 -3.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9990 -0.0850 -3.9410 H 0 0 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 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 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 42 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END