PUBCHEM-ZINC05882031 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.5040 2.3430 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 0.8350 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 0.5320 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 0.0730 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 0.2840 -0.9810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 -0.2960 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 -1.1170 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4350 -1.6600 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1370 -1.3930 -1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5750 -0.5750 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2910 -0.0330 -2.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 0.7810 -3.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2680 -0.2650 -3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5160 -0.7100 -4.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1210 -1.3090 -3.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8070 -0.2030 -5.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9180 -0.3320 -6.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8650 0.3450 -7.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7510 1.1170 -7.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6510 1.2170 -6.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6900 0.5470 -5.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 0.5030 -4.7030 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6880 1.8300 -9.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5970 2.7400 -9.3780 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.3530 2.9340 -8.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5810 3.2590 -10.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2280 0.1770 -8.4820 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 2.8750 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 2.5810 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 2.7360 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 0.5040 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 0.8520 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -0.5410 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 1.0480 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -0.9980 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 0.4370 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 -1.3570 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8790 -2.2990 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1190 -1.8400 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 0.8530 -3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7770 -0.9290 -5.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7780 1.8120 -7.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7000 1.5630 -9.9220 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0120 0.8530 -9.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6070 2.0340 -10.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 M CHG 1 24 1 M END