CHEMDIV-ZINC06877874 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 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 -0.8010 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.1290 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1020 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.8000 -1.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.3510 -2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 0.3680 -2.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 0.8110 -4.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 0.5370 -5.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -0.1870 -4.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -0.6310 -3.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 1.0110 -6.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 1.6400 -6.9040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 0.7450 -7.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 1.2150 -8.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 0.7890 -9.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 1.6150 -9.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7850 1.2280 -9.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8670 0.0140 -10.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 -0.8160 -10.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -0.4230 -9.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8350 -2.0110 -11.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0920 -2.3490 -11.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -3.3340 -1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -4.5270 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -4.5650 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -3.3910 1.4630 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 0.0290 -0.4770 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 0.5810 -2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 1.3710 -4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -0.4000 -5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -1.1940 -2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 0.2420 -6.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 2.3020 -8.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 0.7850 -9.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5370 2.5650 -8.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6490 1.8750 -9.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7940 -0.2890 -10.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -1.0660 -9.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 -3.3250 -12.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 -2.3810 -10.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3560 -1.5980 -12.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -3.5160 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -3.1950 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -5.4510 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -4.4240 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -4.4860 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -5.5040 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -3.5580 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -3.3030 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 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 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END