PUBCHEM-ZINC01139930 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 -0.2820 1.6180 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 0.1160 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -0.1900 1.1540 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7570 0.4230 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -1.6700 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 0.1100 2.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 0.4090 3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 0.4290 3.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.7100 4.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 1.0210 5.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 1.3020 7.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 1.2780 7.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 0.9690 5.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 0.6930 4.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 1.5620 8.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 2.1150 8.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 0.9890 7.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1290 -0.3210 7.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0420 -1.3540 7.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3950 -1.0770 7.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8350 0.2330 7.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9220 1.2660 7.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4020 2.6930 7.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 1.2770 9.6650 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 1.0930 10.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 0.2250 9.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 2.8150 10.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 2.1640 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 1.8360 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 1.9240 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -0.4300 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -0.1900 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 -1.8880 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -2.2820 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -1.8930 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 0.0930 2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 1.0390 5.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 1.5420 7.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2370 0.9510 5.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 0.4570 3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 2.7100 8.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 2.7460 7.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -0.5370 7.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 -2.3770 7.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1090 -1.8840 7.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8920 0.4490 7.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5420 3.0660 6.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3490 2.7390 8.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6620 3.3070 8.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 3.6090 10.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 2.6680 10.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 3.0940 9.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 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 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END