SPECS-ZINC04659872 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 0.1160 1.1160 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.0180 0.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.6470 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -1.7550 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -2.3940 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 -1.9260 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -0.8160 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1820 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 -2.5730 0.1470 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0160 -1.8610 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9700 -0.6480 0.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3200 -2.5550 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3750 -3.9490 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5930 -4.5940 0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7630 -3.8660 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7180 -2.4780 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4990 -1.8210 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9040 -1.7460 0.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.8740 -0.4980 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8350 -0.0450 1.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1080 0.3210 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0990 1.6170 1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2730 2.3460 1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3880 1.8350 1.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.4400 0.6170 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3130 -0.1790 0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2910 -4.6880 0.4760 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.5220 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 1.8780 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 0.8150 2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -2.1180 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -3.2560 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 -0.4520 1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 0.6780 1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9190 -3.5330 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4640 -4.5200 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6330 -5.6720 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4620 -0.7440 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7470 -2.1360 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1890 2.0430 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2760 3.3480 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3770 0.2380 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3620 -1.1740 0.2350 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 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 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 M END