PUBCHEM-ZINC06453264 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.5040 1.5020 -0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 0.1090 -0.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -0.6220 -0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -0.1640 -1.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -2.0310 -0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -2.7390 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 -4.0780 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 -4.4870 0.0280 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 -2.8750 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 -2.5180 -0.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 -3.3700 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8890 -4.5880 -0.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1770 -2.5790 0.0790 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2220 -1.8650 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4720 -3.4270 0.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.4560 -4.3130 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6490 -2.4800 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7110 -1.6080 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6260 -2.2180 1.9670 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7730 -2.0040 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6990 -3.7000 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2170 -1.8780 1.4610 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5020 -2.3660 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6980 -0.4450 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 -0.3410 0.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 1.9950 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 1.6620 -1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 1.9390 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -2.2850 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -4.8360 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9930 -1.4890 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4980 -1.8840 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5810 -3.0440 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5380 -0.5510 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6990 -1.6970 1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6730 -4.1520 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9090 -4.3080 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3180 0.4270 2.0150 O 0 5 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 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 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 21 1 0 0 0 0 19 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 M CHG 1 38 -1 M END