CHEMDIV-ZINC04937622 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 32 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 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -1.2970 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -1.4650 3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 -0.7850 2.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -0.2530 1.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.2520 4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -2.8370 4.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -2.3170 5.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 -3.0940 6.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -4.5600 6.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5070 -2.5430 7.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -1.8580 2.3000 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3900 -2.9430 1.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -1.2350 2.8780 O 0 5 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 3.2360 -1.8500 4.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -3.0200 6.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 -4.9520 5.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -4.6340 5.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -5.1380 6.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 -1.4990 7.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 -3.1210 8.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 -2.6170 6.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 15 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 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END