PUBCHEM-ZINC06129841 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 4.3370 -0.1020 -2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -0.8250 -1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 -0.5240 -0.7510 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 0.1840 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -1.3150 -0.5460 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -2.1450 -1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 -1.8330 -2.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -3.4690 -1.8240 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -4.5550 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -5.2020 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -6.1770 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -6.0300 2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -7.3250 2.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -8.2080 1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -7.5180 0.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -9.6490 1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 -10.5000 2.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -11.8740 2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 -12.4130 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -11.5870 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -10.2110 0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -12.1500 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -11.3550 -2.0830 O 0 5 0 0 0 0 0 0 0 0 0 0 2.6370 -4.8260 -0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -4.2920 0.3150 O 0 5 0 0 0 0 0 0 0 0 0 0 4.6690 -0.5060 -3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1150 0.9610 -2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1620 -0.1970 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 -5.0620 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -5.0840 2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -7.5690 3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -10.1060 3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -12.5250 3.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7690 -13.4830 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -9.5670 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -13.3820 -1.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 -5.5360 -1.5950 O 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 2 7 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 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 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 2 0 0 0 0 24 25 1 0 0 0 0 24 37 2 0 0 0 0 M CHG 1 23 -1 M CHG 1 25 -1 M END