PUBCHEM-ZINC06373241 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1030 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -0.5360 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 -1.9140 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -2.6670 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -2.0210 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 -4.1440 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6800 -4.9040 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -6.1980 -0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9920 -6.2780 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -5.0170 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -4.7760 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 -7.7690 -0.0330 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 -7.2730 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2090 -7.3370 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 -8.4140 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9120 -9.4300 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8890 -9.3710 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -8.2950 -0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7210 -10.4810 -1.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7110 -11.4480 -1.7240 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.8380 -9.9600 -3.2220 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.4590 -11.0640 -1.7730 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 1.1820 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 0.0460 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 -2.4100 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -2.5980 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6940 -4.5340 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -7.9680 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3340 -6.5460 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8720 -8.4660 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5890 -10.2710 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 -8.2480 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 M CHG 1 11 1 M END