OTAVA-ZINC05235963 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 0 0 0 0 0 0999 V2000 0.5770 0.4890 -1.3010 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 0.5810 0.2190 1.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -0.7560 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -1.2150 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 -1.9160 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 -2.1720 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 -1.7180 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -1.0100 -1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 -2.8860 0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9900 -2.2490 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0630 -1.0390 0.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1790 -3.1180 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4830 -2.7510 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5340 -3.7700 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8810 -3.5200 0.3090 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.3010 -2.6500 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5240 -4.7390 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8560 -5.1290 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1800 -6.4660 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1840 -7.4250 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8690 -7.0630 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5130 -5.7110 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3330 -5.0640 0.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5150 -4.7550 -0.0270 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -4.2190 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -5.2170 -0.2440 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 1.0210 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -0.3590 -1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 1.1630 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -1.0180 2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 -2.2720 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 -1.9180 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -0.6540 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7440 -1.7080 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6350 -4.3880 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2160 -6.7700 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4540 -8.4680 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1030 -7.8180 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M END