IBS-ZINC05487112 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 1 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 -0.7940 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.1240 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.0750 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7760 -1.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -3.1870 -1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.9940 -2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -4.0080 -4.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -5.2020 -3.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -3.5330 -5.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -2.2090 -5.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -1.4020 -6.9460 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -1.4540 -3.8340 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -4.4490 -6.3840 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0220 -5.4780 -6.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -4.2220 -7.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -4.5980 -6.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -5.0050 -5.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -4.1900 -7.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -3.3300 -6.9130 O 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 0.0290 -0.4640 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -3.0120 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -4.1890 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -3.1720 -7.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 -4.8400 -8.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -4.4810 -6.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 -4.9160 -8.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -4.7140 -8.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4450 -4.7340 -6.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 14 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 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 M END