IBS-ZINC02343651 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.7740 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.0820 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6930 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.0100 -2.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -0.3010 -3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 0.5460 -4.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 0.2710 -5.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 0.5820 -4.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -0.2650 -3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 0.9680 -6.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 0.8530 -7.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 1.5830 -8.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 1.2780 -9.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 1.6930 -10.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 1.2200 -10.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9340 0.3290 -10.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 -0.0860 -8.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 0.3820 -8.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 0.1390 -7.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 -0.4470 -6.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1470 -0.1320 -10.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8190 -1.0420 -9.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7520 1.6230 -12.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 2.5360 -12.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 2.3530 -8.7740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 2.4300 -7.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 1.7640 -6.7860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -4.5100 -0.0150 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.1660 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6270 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.6200 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -0.0770 -2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -1.3580 -3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 1.6030 -4.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 0.2960 -5.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 1.6390 -4.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 0.3580 -4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -1.3220 -3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -0.0150 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 2.3830 -11.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9640 -0.7750 -8.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9950 -0.5580 -8.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7730 -1.3310 -10.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2020 -1.9280 -9.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 2.0800 -13.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 2.7750 -13.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 3.4490 -12.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 3.0620 -8.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 31 2 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 M END