ASINEX-ZINC05018078 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.2060 1.9310 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 0.8190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 0.1320 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 0.5730 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 1.6700 -0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 2.3530 -0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4480 -0.1840 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 -1.3770 -0.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 0.4760 -0.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8920 -0.2120 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9210 -0.2600 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9070 1.8260 1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 1.8250 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3010 1.2220 2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6140 1.2790 1.2940 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8850 0.2870 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7610 1.8560 2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9290 1.8060 1.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1130 2.1850 1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2390 1.9950 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5160 2.3350 1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6620 2.8740 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5430 3.0740 3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2690 2.7290 3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9970 3.2310 3.2900 N 0 3 0 0 0 0 0 0 0 0 0 0 17.9630 3.0370 2.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0810 3.7030 4.4320 O 0 5 0 0 0 0 0 0 0 0 0 0 9.3590 2.1050 0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2390 2.2910 -0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 2.4620 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 0.4840 1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -0.7440 1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 1.9880 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 3.2090 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 -1.2280 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2960 0.3430 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5570 -0.8460 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8690 -0.6720 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1590 2.8520 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 1.2730 2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 2.4640 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 2.2380 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2310 0.3680 2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1550 2.1520 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5470 2.9000 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9040 1.2530 3.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1240 1.5750 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3710 2.1720 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6380 3.4950 4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4230 2.9030 3.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1820 1.1490 1.0590 N 0 3 0 0 0 0 0 0 0 0 0 0 7.5870 1.7000 0.2690 H 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 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 7 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 51 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 28 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 28 29 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M CHG 1 51 1 M END