IBS-ZINC02277419 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 51 0 0 0 0 0 0 0 0999 V2000 0.4480 1.5190 1.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 0.3970 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -0.3120 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 0.1050 0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 1.2390 1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 1.9380 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -0.6490 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 0.0020 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9320 -0.7220 -0.7330 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 -0.1940 -1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1030 1.0050 -1.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0350 -1.1310 -1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2030 -0.8460 -2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0540 -1.9340 -2.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4960 -3.1830 -3.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2980 -4.2000 -3.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6610 -3.9900 -3.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2210 -2.7520 -3.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4270 -1.7260 -3.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4480 -4.9970 -4.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4330 -2.7230 -1.2760 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -2.1020 -0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 -2.7290 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -2.0350 0.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 1.4680 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 2.0700 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 3.4420 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 4.2230 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 3.6350 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 2.2640 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 2.0730 2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 0.0750 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -1.1880 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 1.5670 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 2.8150 2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5060 0.1820 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4370 -3.3480 -3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8690 -5.1640 -3.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2810 -2.5940 -3.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8630 -0.7640 -2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5290 -5.0240 -5.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 -2.5120 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 1.4620 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 3.9080 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 5.2970 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4670 4.2510 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5510 1.8070 0.7680 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 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 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M END