PUBCHEM-ZINC00688130 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 60 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -1.8380 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 -2.5660 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 -2.4160 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1130 -3.7480 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -4.0760 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0860 -5.3690 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4780 -5.4500 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2340 -4.2640 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6370 -3.0880 0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3110 -2.9500 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 -1.4870 0.0430 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.6710 -4.6490 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6200 -3.8920 0.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7260 -6.1280 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4040 -6.6080 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1740 -7.9780 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2420 -8.8600 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5410 -8.3870 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7880 -7.0250 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 -6.5940 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -6.8930 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6610 -8.0360 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 -8.8890 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 -8.5940 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 -7.4560 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -10.0140 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -10.8460 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -4.7170 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -4.9390 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -5.9530 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -6.3740 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -5.6060 -1.0140 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 -6.1620 -8.3560 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0590 -9.9240 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3660 -9.0840 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8050 -6.6600 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 -6.2300 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 -8.2680 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 -9.2600 -1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 -7.2300 -1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -11.1870 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -10.2780 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -11.7080 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -4.3950 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -6.3670 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -7.1700 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -5.6790 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 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 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 35 1 0 0 0 0 32 33 2 0 0 0 0 32 52 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 34 35 2 0 0 0 0 34 54 1 0 0 0 0 35 55 1 0 0 0 0 M END