IFLAB-ZINC05240792 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 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 -2.7600 -2.5460 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6510 -4.0250 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -4.7160 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 -4.0400 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -5.1400 2.2720 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -6.5140 1.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -6.1500 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 -7.1150 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -7.5640 -1.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -7.5060 0.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -7.8210 1.9510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -8.0730 2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -7.1530 3.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -9.4620 3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -10.5230 2.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -11.8200 3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -12.0810 4.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -11.0470 4.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -9.7310 4.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 -8.4060 5.1560 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -9.2630 6.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -8.2330 7.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -2.5290 1.2510 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 -3.2430 -1.9940 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -2.4510 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 -4.4810 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -4.1140 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -7.1480 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1810 -8.1440 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -8.5540 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -10.3260 1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -12.6380 2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -13.1020 4.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -11.2590 5.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 -9.8450 7.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 -9.9280 5.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 -8.7480 7.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 -7.6510 6.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 -7.5680 7.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -2.1300 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -2.2400 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0020 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 52 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 M END