OTAVA-ZINC05374257 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 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 1.1870 -2.3900 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -2.5120 -2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -3.2090 -3.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -2.5340 -1.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -3.3060 -0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -3.6280 0.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -3.7470 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -4.5410 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -4.8620 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3640 -5.6500 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7380 -5.9850 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5300 -6.8000 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8180 -7.1090 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3280 -6.6160 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5500 -5.8100 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2630 -5.4870 -1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -3.0080 -2.2060 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -2.2130 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -1.2270 -3.7540 S 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 -2.8820 -4.9240 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0010 -4.4790 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9630 -6.0330 1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1340 -7.1850 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4310 -7.7380 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3370 -6.8620 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9550 -5.4300 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6590 -4.8540 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -2.1700 -2.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -2.5050 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 39 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 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 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 39 40 1 0 0 0 0 M END