PUBCHEM-ZINC06453304 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5140 0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 0.1220 0.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -0.6420 1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -2.0640 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -3.2370 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -4.6770 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -5.4670 1.8540 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9080 -5.3000 2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -6.9660 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 -7.4520 1.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -5.1640 1.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -4.7890 3.0720 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 -4.5700 2.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9010 -3.7880 3.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -6.3090 3.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -7.3620 3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 -8.5510 4.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -8.7040 5.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -7.6220 5.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -6.4280 5.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 -9.9570 6.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -10.6510 6.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -11.8410 7.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -12.3670 7.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8640 -11.6900 7.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8350 -10.4990 6.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -13.5320 8.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 -14.1130 8.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 1.8450 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 2.0460 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 1.7520 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 -0.3390 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.4510 2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -5.0300 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -4.8310 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -6.0290 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 -7.2760 2.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 -9.3700 3.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -7.6990 6.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -5.6090 5.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -10.2770 6.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -12.3640 7.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8280 -12.0550 7.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7750 -9.9870 6.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4380 -14.3810 8.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2790 -13.4500 9.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 -15.0350 9.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -7.4930 1.6400 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 3 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 9 48 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 M CHG 1 48 -1 M END