IFLAB-ZINC02966454 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 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 0.0230 -0.7020 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0850 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7780 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.0920 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6970 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.0090 -2.3960 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1100 0.3480 -3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 0.0490 -2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4600 1.1000 -3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 1.1690 -4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 1.7770 -4.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 1.0440 -4.1770 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 0.9010 -4.4920 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1580 0.4350 -3.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -0.1390 -5.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -0.1880 -6.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -1.2370 -7.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -2.0410 -7.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -1.4790 -5.9030 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 2.1550 -4.8800 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 0.0250 -0.1670 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6260 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8580 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.6340 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -0.9450 -2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 0.1000 -1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 0.8230 -2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 2.0730 -2.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 0.1650 -5.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 1.7920 -5.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 1.6910 -6.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 2.8260 -4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 1.2610 -2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -0.3930 -3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 0.5370 -6.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -1.3940 -8.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -2.9070 -7.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 2.1130 -5.0980 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 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 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 22 43 1 0 0 0 0 M CHG 1 8 1 M END