IFLAB-ZINC04355887 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8240 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -2.3500 2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -3.7160 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -4.5690 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -4.0370 0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.6710 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -6.0380 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -6.8950 0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -8.2580 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -8.6940 2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -7.8100 2.9900 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -6.5450 2.8110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -10.4190 2.4320 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -10.4560 3.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -11.8870 4.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 -12.5260 3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 -13.8380 4.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 -14.5110 5.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 -13.8720 5.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -12.5580 5.1860 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 -1.0200 -0.3810 0.0100 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 1.8880 -1.6890 3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -4.1250 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -4.6960 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -2.2580 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -6.5040 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -8.9630 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -9.9370 3.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 -9.9630 4.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 -12.0000 3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 -14.3380 3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 -15.5370 5.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -14.3980 6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -12.0580 5.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 M END