IBS-ZINC01251368 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 0 0 0 0 0 0999 V2000 0.0250 1.4870 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 0.2240 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -0.4830 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 0.0670 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 1.3400 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 2.0440 -1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 -0.6820 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 -0.8400 -1.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4660 -1.5900 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1940 -2.0770 -0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3480 -2.8470 -0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7480 -3.1100 -1.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0540 -2.6320 -3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8960 -1.8550 -2.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7450 -3.0800 -4.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8230 -3.8130 -3.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8160 -3.8260 -2.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5200 -4.3070 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8690 -4.4990 -4.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8480 -4.4770 -5.8250 O 0 5 0 0 0 0 0 0 0 0 0 0 7.3460 -2.7730 -5.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9440 -1.4510 -6.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5240 -1.1460 -7.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 0.1820 -8.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1530 0.4520 -8.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0450 -0.3040 -8.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1910 1.8890 -8.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1600 2.6820 -9.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9020 4.0560 -9.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6970 4.5930 -8.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7280 3.7670 -8.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0040 2.4190 -8.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2110 1.3200 -7.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 1.4560 -7.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 2.0360 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -0.2110 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -1.4660 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 1.7870 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 3.0300 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 -0.1010 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -1.6660 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8960 -1.8770 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 -3.2250 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3320 -1.4650 -3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6270 -3.5900 -6.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2510 -2.7160 -5.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6230 -0.6350 -5.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0400 -1.4820 -6.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9620 -1.8830 -8.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4330 -1.1920 -7.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0840 2.2600 -9.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6400 4.7200 -9.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5210 5.6650 -9.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7970 4.1680 -8.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7360 -5.0810 -3.8320 O 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 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 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 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 55 2 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 33 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 2 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 M CHG 1 20 -1 M END