IBS-ZINC02439253 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 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 1.1930 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 0.0590 -4.1670 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.8930 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -6.3760 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -7.1320 -0.8830 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -8.3950 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -8.4210 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -7.1250 -0.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -6.6530 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 -6.2390 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -6.3300 1.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 -5.7680 0.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -9.6470 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 -9.6950 -0.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -10.7640 -0.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -10.7240 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -11.7520 -0.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -9.5760 -0.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -9.5760 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -12.0400 -0.0180 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 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6240 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6010 -2.1510 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 0.0740 -4.6570 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -4.6390 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -4.6140 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2070 -7.4540 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -5.7990 -1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 -5.6960 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 -5.5020 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 -9.7580 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1190 -10.3610 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -8.6090 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -12.1750 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -12.8550 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -12.0390 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 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 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M END