IBS-ZINC05254067 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 0 0 0 0 0 0999 V2000 -0.0500 1.5330 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 0.1420 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -0.5510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 0.1270 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 1.5360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 2.2310 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -0.6100 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8240 0.1270 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9540 -0.6140 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3180 -0.2220 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0190 0.9980 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4210 0.9670 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1160 -0.2450 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4390 -1.4680 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0480 -1.4080 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2150 -2.4860 -0.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 -1.9960 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 -2.7110 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6190 -1.9660 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 -4.0760 -0.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 -4.8680 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 -6.3660 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 -6.5880 -0.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 2.0720 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -0.4130 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -1.6400 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 2.1100 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.3180 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4870 1.9440 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 1.9040 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2040 -0.2390 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9620 -2.4170 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5820 -4.6410 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 -4.6660 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -4.6540 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -7.1830 -0.0670 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 19 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 M CHG 1 36 -1 M END