IBS-ZINC05253417 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 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 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.7040 2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -0.5010 2.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -1.2040 3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -1.3580 4.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -1.8040 5.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -2.0860 5.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -2.5350 7.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -2.7110 8.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -2.4290 8.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -1.9680 6.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -2.6740 9.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -3.1150 10.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -3.4470 11.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -3.3410 11.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -4.4180 12.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9600 -4.3090 12.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 -3.1420 12.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 -2.0730 11.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -2.1610 11.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -0.8170 10.8260 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -5.8840 12.7890 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -3.1680 9.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -3.5130 10.1790 O 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 1.1040 -2.1660 3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -0.4860 3.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -1.9500 5.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 -2.7540 7.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -1.7410 6.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -3.7890 12.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 -5.1380 13.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6960 -3.0640 12.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -1.1660 11.8080 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 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 40 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 25 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 26 27 2 0 0 0 0 M END