ASINEX-ZINC04497861 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -0.6890 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -1.1920 3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -1.4190 4.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -1.9010 5.8070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -2.1700 6.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 -2.0130 7.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -2.6660 8.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -2.8920 9.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -3.3630 10.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 -4.5470 10.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 -4.4660 8.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 -3.9820 7.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -5.9460 11.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -6.6620 10.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -5.5720 12.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -6.9080 10.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -7.8070 9.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -8.5620 8.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 -8.4170 9.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -7.5170 10.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -6.7670 10.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -9.3640 8.6960 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 0.2500 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -1.4300 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -2.1310 3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -0.4520 3.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -0.4800 4.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -2.1600 4.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -2.0260 5.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -1.9250 8.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -1.9600 9.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -3.6520 9.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -2.5690 10.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -3.6200 11.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 -3.7610 9.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 -5.4500 8.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -4.7320 7.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -3.8260 6.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -7.9200 8.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -9.2640 8.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1560 -7.4030 10.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -6.0670 11.6810 H 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 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 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 16 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 M END