IFLAB-ZINC05145397 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.5850 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 -1.8100 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -3.9130 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3510 -4.3920 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6970 -5.7260 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0660 -5.9510 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8030 -4.8190 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7490 -3.4140 0.0460 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.2640 -4.7710 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9070 -5.8040 0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8990 -3.5800 0.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3280 -3.6080 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8650 -2.1750 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6750 -7.3290 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 -6.8110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 -7.2670 1.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -7.3020 -1.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 -8.3840 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -4.5340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6900 -4.1230 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6730 -4.1340 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9550 -2.1960 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5030 -1.6600 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5210 -1.6500 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8110 -7.6680 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6410 -7.2990 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0130 -8.0180 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -6.9390 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -8.6470 -2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -8.0560 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 -9.2560 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 13 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 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 M END