IFLAB-ZINC01916086 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.7680 -0.1230 -4.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -1.1390 -3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -1.2750 -3.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 -2.2080 -2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -2.8700 -1.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -2.4250 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 -1.6670 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1030 -1.8390 -0.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1490 -2.7450 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3120 -2.9060 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3380 -3.8330 2.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2280 -4.6260 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 -4.4960 1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0220 -3.5530 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 -3.3950 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -4.1630 0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -5.4150 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -5.8820 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -7.1180 -2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -7.8920 -1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 -7.4330 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -6.1920 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 -7.6160 -2.9230 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4850 -6.9030 -3.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 -8.7380 -3.3900 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.5900 -4.0000 2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5260 -2.0580 0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -0.0210 -5.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -0.4660 -5.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 0.8420 -4.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -2.1040 -4.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -0.7960 -3.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0470 -0.9240 -2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2740 -5.3530 3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -5.1160 1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -3.8360 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 -5.2800 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -8.8580 -2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -8.0400 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2770 -4.6710 2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3320 -4.4210 3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0660 -3.0290 3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2080 -2.6020 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0280 -1.8260 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2190 -1.1320 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -5.7380 0.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -5.9850 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 15 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END