IBS-ZINC05156233 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 37 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3990 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 1.3320 -0.3790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 0.7470 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 1.8160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -1.7030 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -1.9310 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8330 -3.1770 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 -4.2260 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 -3.1560 -0.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 -1.9350 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 -0.7280 -0.0530 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0700 -2.0920 -0.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3590 -3.4030 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2390 -4.0900 -0.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7150 -3.9790 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7880 -3.1710 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1440 -3.7480 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2630 -2.9090 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5290 -3.4540 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6940 -4.8310 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5890 -5.6670 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3180 -5.1340 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9380 -5.3590 -0.1740 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 2.0270 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -0.6620 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 2.8470 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -2.5350 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8470 -5.0510 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6570 -2.1000 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1350 -1.8370 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3940 -2.8080 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7240 -6.7390 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4570 -5.7870 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 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 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 M END