PUBCHEM-ZINC06616165 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 -0.8990 2.1880 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 0.8750 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 0.0730 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 0.0630 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -1.0990 -0.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -1.9830 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 -3.1480 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -4.1340 -1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0930 -3.9570 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2570 -2.8000 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 -1.8140 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 -5.0350 -0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7420 -6.1870 -1.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4430 -4.6050 -0.7570 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6580 -5.3310 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7600 -7.0000 -0.6020 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.6960 -4.4130 -0.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.1070 -4.4670 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8750 -5.6310 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2680 -5.5700 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9040 -4.3430 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1600 -3.1690 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7590 -3.2110 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9590 -1.9180 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6890 -2.0470 -0.3050 O 0 5 0 0 0 0 0 0 0 0 0 0 -15.6180 -4.2800 -0.0410 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 2.7840 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 2.7870 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 2.0080 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 1.1040 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 0.6620 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -0.2130 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -0.8410 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -0.2270 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 0.6780 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -3.2900 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 -5.0340 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1360 -2.6450 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 -0.9280 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5770 -3.6010 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3990 -3.4100 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4350 -6.6090 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8480 -6.4880 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6590 -2.2090 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5910 -0.8330 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 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 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 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 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 2 0 0 0 0 M CHG 1 25 -1 M END