PUBCHEM-ZINC01074152 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 0.0580 1.2170 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -0.0750 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -0.6360 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 -0.0030 -1.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 1.2640 -0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 1.8960 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 1.9220 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9770 1.3160 -0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1570 1.9980 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1190 3.2870 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2580 4.0560 0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1170 5.3200 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 5.8390 1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7290 5.0830 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 3.8190 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 3.1590 0.3040 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5100 6.2370 1.7070 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.4360 1.3340 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2960 1.9390 -1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5540 0.0340 -0.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7190 -0.7620 -0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4830 -2.2060 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 -2.9820 -0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3540 -4.3060 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 -4.8550 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8040 -4.1040 1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0680 -2.7770 1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5530 -6.5620 1.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0990 -6.7040 2.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0940 -6.5600 0.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2800 -7.4610 -0.0820 N 0 5 0 0 0 0 0 0 0 0 0 0 9.2620 -7.3320 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 1.6960 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -0.6300 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -1.6460 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 2.9060 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 0.3350 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2610 3.6700 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7230 6.8230 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 5.4940 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8260 -0.3920 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9510 -0.6550 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5690 -0.3520 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1570 -2.5520 -1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6810 -4.9020 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2580 -4.5380 2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7260 -2.1880 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 31 32 1 0 0 0 0 M CHG 1 31 -1 M END