IBS-ZINC00508544 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4260 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0020 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -0.6350 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -2.0240 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -2.6700 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.9270 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -0.5300 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1080 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9550 -2.6150 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 -3.8300 0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0950 -1.8960 0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2880 -2.5250 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3540 -4.2360 0.0480 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.4280 -1.8060 0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6590 -2.4510 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8250 -1.6990 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0410 -2.3520 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0490 -3.7410 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8520 -4.4240 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7070 -3.7740 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8040 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 1.7860 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.7790 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -2.5980 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -3.7490 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 0.0470 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 1.1870 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0580 -0.9270 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3910 -0.8400 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7830 -0.6200 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9640 -1.7950 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9810 -4.2810 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8540 -5.5040 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 29 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 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 M END