IBS-ZINC01451552 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -1.2500 -0.1320 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -0.0870 2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 2.0720 0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 2.8750 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 4.3600 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 5.1290 -1.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0230 5.6120 -0.9270 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6120 4.7540 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4840 6.0580 -2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 6.1290 -3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 5.4730 -2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 5.2460 -2.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 6.5600 -4.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7580 6.2200 -2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7690 5.9830 -1.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1810 6.5950 -3.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0120 5.9020 -4.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1930 6.6980 -5.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8980 6.5720 -7.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8370 7.6230 -8.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0880 8.7730 -7.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3740 8.9120 -6.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4600 7.8520 -5.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8560 7.7950 -4.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0570 6.7390 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0610 6.7730 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0670 7.8120 1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 8.7910 1.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 8.6910 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 7.6930 0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -1.1610 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -0.1030 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 0.3430 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -0.0520 2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -1.1190 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 0.4270 2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 2.1260 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 2.4330 1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 2.5240 -1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3470 2.7320 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 4.7420 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 4.5050 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6060 6.3010 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4390 4.9250 -4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4790 5.6810 -7.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3810 7.5400 -9.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0560 9.5730 -8.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 9.7950 -6.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 6.0120 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8380 7.8610 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0650 9.6120 2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 9.4320 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 0.6140 0.6900 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9650 0.5750 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 53 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 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 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 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 53 54 1 0 0 0 0 M CHG 1 53 1 M END