PUBCHEM-ZINC06159141 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 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 0.0220 -0.6570 1.1180 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0240 0.0690 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.1220 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6830 -1.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 0.0240 -2.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 0.6440 -2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 1.3100 -3.9530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 1.4220 -4.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 0.8140 -4.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 0.0810 -3.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1690 -0.4760 -2.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 1.0270 -5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 1.7640 -6.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 2.2510 -6.2670 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8240 2.1320 -7.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 1.2090 -7.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 1.2020 -6.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 0.4580 -5.1000 C 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 -1.0030 0.2350 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -0.5170 3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 1.0290 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -2.4710 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -2.4960 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -2.4870 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -1.6520 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 0.5810 -2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 3.1680 -7.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 2.0090 -8.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8050 1.5720 -8.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7480 0.1980 -7.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7220 2.2280 -5.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5710 0.6990 -6.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -0.6030 -5.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 0.5910 -4.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 M CHG 1 3 1 M END