IBS-ZINC02296438 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 65 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1970 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 1.4200 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 1.8410 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 0.7280 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -0.3740 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 -1.2920 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 0.7360 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5310 2.1170 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 3.1540 0.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3180 3.2470 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3730 3.9950 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7260 4.8440 1.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8560 3.8810 1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6530 4.6750 2.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0200 5.7100 3.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4820 7.2880 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1150 6.2530 1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2790 8.0820 4.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3410 9.4250 3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2220 10.2370 3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2740 11.4700 2.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4490 11.8960 2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5760 11.0780 2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5180 9.8460 2.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5930 11.7160 1.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1980 13.0990 1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7600 13.0460 1.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4060 0.5250 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4080 -0.0230 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 2.2210 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3830 2.2270 -1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 3.7110 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 3.8330 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0830 2.8900 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3920 4.0300 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3290 4.7730 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7400 3.6730 3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3610 5.5940 4.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0540 5.5610 4.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3950 8.2890 2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8060 7.1900 3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0810 6.4010 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7740 6.3690 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2630 7.8290 4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5590 8.1210 5.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3050 9.9060 3.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3980 12.1020 2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3920 9.2120 2.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5760 13.6480 2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5490 13.5520 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2710 4.9020 2.3090 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8640 7.0600 3.2620 N 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 59 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 59 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 60 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 60 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 21 59 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 22 60 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 M END