IBS-ZINC00542080 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 0 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 -0.7000 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0810 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0680 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.1710 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -4.9800 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -6.2910 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -7.2250 -1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -6.7040 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -4.9500 -2.3570 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 -7.4880 -3.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -8.7040 -3.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 -6.8620 -4.4150 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7410 -7.6460 -5.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 -6.9760 -6.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1610 -7.2070 -5.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -6.2350 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -4.9880 0.8910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -7.4220 1.3320 C 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 0.0240 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6250 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6020 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -8.2900 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -5.8930 -4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -8.7140 -5.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -5.9520 -6.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 -7.6040 -7.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8820 -7.9880 -6.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5670 -6.3360 -5.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -7.6930 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -7.1690 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -8.2640 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END