IBS-ZINC02218109 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 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 0.7390 -2.0270 -1.2650 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2790 -2.4050 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -2.5140 -2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -3.1980 -2.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -2.1900 -3.7330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -2.6640 -4.9930 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4180 -2.6860 -4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -4.0720 -5.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -1.7330 -6.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -0.7730 -5.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -2.5110 -0.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -3.3020 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -3.6260 0.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -3.7550 1.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -4.5730 2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -4.9720 3.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -4.5670 3.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 -3.7600 2.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 -3.3410 1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 -2.5470 0.9040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -2.1600 -0.0550 N 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 0.5290 -0.3650 0.8850 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 0.1910 -0.1360 -2.1400 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 -0.0480 -1.6430 -3.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -4.4240 -6.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -4.7450 -4.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -4.0500 -5.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -4.8910 2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -5.6060 4.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2020 -4.8890 4.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0800 -3.4510 2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -1.9710 -7.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -1.3460 -8.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 40 41 1 0 0 0 0 M END