IFLAB-ZINC04248507 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.2260 -0.6930 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -2.0420 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -2.7560 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -4.0990 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -4.2440 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -3.0320 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -2.1120 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -0.7030 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -5.5550 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 -5.5980 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9460 -6.8730 1.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -7.3600 2.5340 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3810 -8.5990 2.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8730 -7.2000 3.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0780 -6.2100 2.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3130 -6.4300 2.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3420 -5.5290 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1380 -4.4020 3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8970 -4.1820 3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 -5.0920 3.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6780 -3.0860 4.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6130 -2.0090 4.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0300 -2.5980 4.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1590 -3.5190 3.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -0.1400 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -2.5620 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -4.8950 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -0.1840 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -5.6510 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 -6.3760 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -5.5020 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -4.7770 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -7.4320 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4740 -7.3070 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3060 -5.7040 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9050 -4.9250 4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4860 -1.3120 5.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4520 -1.4920 3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1890 -3.1200 5.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7630 -1.7990 4.3520 H 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 10 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 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 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END