IFLAB-ZINC00134795 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.2590 -0.1030 -5.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 1.3320 -5.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 1.7210 -6.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 3.0350 -7.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 3.9860 -6.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 3.6250 -4.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 2.3070 -4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 1.9170 -2.7010 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 0.7420 -2.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 3.1290 -1.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 1.4770 -2.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 2.4940 -1.7350 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4980 2.9670 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 1.7730 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 0.7230 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 0.6480 0.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 3.5490 -2.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 4.9040 -2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 5.8830 -3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 5.5180 -4.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 4.1760 -4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 3.1970 -3.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -0.6040 -4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -0.1800 -4.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -0.6580 -5.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 0.9950 -7.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 3.3120 -8.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 5.0080 -6.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 4.3820 -4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 0.6180 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 2.4960 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 1.2490 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 5.2060 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 6.9290 -3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 6.2800 -5.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 3.8880 -5.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 2.1520 -4.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 0.0490 -0.4850 O 0 5 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 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 38 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 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 M CHG 1 38 -1 M END