IBS-ZINC02274629 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2040 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4290 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.6850 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -1.9000 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 0.0080 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1320 -0.7040 -0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0430 -1.6260 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5150 -1.0360 -1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1000 -0.2080 -1.7980 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3020 0.4670 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1920 0.1610 0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1360 0.6090 1.7790 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1660 1.4160 2.2790 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1070 1.8920 3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1270 2.6920 4.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0650 3.1610 5.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9880 2.8340 6.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9700 2.0370 5.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0240 1.5700 4.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 1.6900 6.5620 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7660 2.1400 7.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 0.9310 6.0940 O 0 5 0 0 0 0 0 0 0 0 0 0 10.1520 4.0140 5.9180 N 0 3 0 0 0 0 0 0 0 0 0 0 11.1780 4.3250 5.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0930 4.4610 7.1550 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9880 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 0.9780 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6260 -2.1140 -1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7590 -0.6560 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1540 1.0760 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 0.3800 2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9210 1.6450 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9680 2.9480 3.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9420 3.2020 7.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2270 0.9510 4.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 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 41 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M CHG 1 27 1 M CHG 1 29 -1 M END