IBS-ZINC06669817 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 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 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -4.7670 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 -4.9620 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 -4.7000 -3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 -4.2300 -3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4520 -4.0300 -1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 -4.3070 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8260 -3.5330 -1.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2990 -3.3400 -0.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5450 -3.2990 -2.9240 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0020 -3.5200 -4.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 -3.9580 -4.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9200 -2.8040 -2.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9120 -1.2970 -2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9990 -0.5980 -3.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9910 0.7840 -3.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8970 1.4670 -2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8110 0.7690 -1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8230 -0.6140 -1.6090 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 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -5.3260 -2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -4.8560 -4.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -4.1610 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6090 -3.3210 -5.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5010 -3.1590 -3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3660 -3.1710 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0720 -1.1320 -4.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0580 1.3300 -4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8900 2.5470 -2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7370 1.3030 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7590 -1.1600 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 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 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 M END