PUBCHEM-ZINC05631687 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 1 0 0 0 0 0999 V2000 0.4160 1.6720 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.3840 -1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 1.3800 -2.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 1.1650 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 1.0860 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 0.8350 1.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9600 1.3020 0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 1.2810 1.1580 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5870 0.7040 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4050 0.9480 0.7630 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9470 0.2870 1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6880 2.3440 0.9680 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5330 2.6880 1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1310 3.7210 2.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9000 2.9510 0.4540 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.5920 3.9370 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3350 2.0160 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8770 0.8310 -1.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.5580 2.8090 -2.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5540 1.1280 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0210 3.2000 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9780 2.5040 2.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 0.7620 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 2.4230 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 2.0790 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 1.0000 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 1.5080 -2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 1.4920 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6710 3.3900 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8080 2.1540 -2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3870 3.5160 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4630 1.7290 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7470 0.4300 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4270 0.5350 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8790 4.0610 1.1240 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 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 19 1 0 0 0 0 17 20 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 M CHG 1 35 -1 M END