CHEMBRIDGE-ZINC04978678 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 0 0 0 0 0 0999 V2000 -2.2100 1.5020 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 0.0830 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -0.0650 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7670 -0.8040 0.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 -2.1410 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -2.6950 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -4.0760 -0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 -4.9170 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -4.3780 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -2.9960 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 -2.4460 1.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9210 -2.7380 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8260 -1.5350 0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8740 -0.0850 -1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1020 -0.0150 -1.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4660 1.0560 -2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7910 0.9650 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9480 2.1990 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2640 3.3210 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 2.2430 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 1.6140 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 1.7290 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -0.0710 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -1.0640 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 0.6660 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 0.0710 2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -2.0910 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -4.4970 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 -5.9900 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2960 -5.0410 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 -2.9230 -0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3500 -3.6290 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7840 -1.6020 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0110 -1.4600 1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 -0.9350 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2460 0.8030 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7140 -0.9110 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3600 1.0310 -3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8890 1.9760 -2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9780 0.7140 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7620 1.1030 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0350 2.1860 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1730 3.4100 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6120 4.1890 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1290 -0.2400 0.4260 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.1860 -0.3210 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END