PUBCHEM-ZINC06888368 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 -1.8030 4.5770 1.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 3.2570 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 2.3770 0.7860 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 2.4190 -0.4640 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8220 3.1510 -1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7250 2.8090 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5350 2.5130 -1.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8610 0.8940 -1.9860 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6480 0.9100 -3.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 -0.1500 -1.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 1.0270 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8650 1.5280 1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 0.7990 1.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 1.4840 3.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 0.5130 3.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 0.3480 5.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 1.0120 5.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -0.6280 6.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -0.8920 7.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -0.3880 7.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 0.1810 8.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 0.6510 8.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 0.5600 7.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -0.0030 6.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -0.4820 6.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 1.0660 7.9530 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7170 1.5620 9.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 0.9880 7.0440 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9420 5.2320 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 5.0590 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 4.3820 2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 3.4520 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 2.7750 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1090 2.2120 0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 3.8690 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5990 2.4360 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3500 3.2760 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 0.9560 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 0.2490 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 1.2120 2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 2.4640 3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 -1.1380 5.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -1.4720 8.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 0.2540 9.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 1.0920 9.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 -0.0710 5.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.9250 5.4300 H 0 0 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 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 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 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END