IBS-ZINC04897738 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7130 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1010 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7000 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.9920 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6670 -1.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6530 -2.3710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -1.9800 -3.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.6200 -4.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -1.9000 -5.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -2.4660 -7.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -1.5220 -8.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -0.2190 -7.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -0.1470 -5.9580 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 0.9710 -8.5420 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1010 0.8220 -9.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 2.1790 -8.0170 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0650 -2.9130 2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1970 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -3.6220 -2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -3.7000 -4.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -3.5260 -7.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -1.7610 -9.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -3.1230 2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -3.8510 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -2.3520 3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END