PUBCHEM-ZINC05573489 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 0.6850 1.6070 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 0.1030 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -0.3560 -1.3150 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 -0.7460 -1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 -0.7950 -0.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -1.0370 -3.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -1.0830 -3.5220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6620 -0.5440 -4.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.4380 -2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -0.0730 -2.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -2.7550 -3.7300 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -3.3430 -4.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -3.3590 -2.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -2.6030 -4.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -3.9570 -4.8690 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1700 -4.5340 -5.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 -4.7470 -3.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -3.7480 -5.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6710 -2.6710 -6.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 -4.8120 -6.7630 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -6.0670 -6.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 -6.4920 -8.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 -6.0570 -8.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 -4.7740 -7.6990 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4040 -3.8750 -8.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9350 -4.8280 -7.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -5.1350 -5.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 1.8980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 2.1430 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 1.9360 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -0.4070 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -0.1610 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -0.2030 -3.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -1.9630 -3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -2.1410 -3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -1.9150 -5.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -5.6910 -4.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 -4.9890 -2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3670 -4.1790 -3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -5.9610 -6.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 -6.7780 -6.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -5.9460 -9.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -7.5630 -8.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5930 -5.8830 -9.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0410 -6.8510 -8.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8700 -4.5970 -7.9150 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 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 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 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 24 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 M CHG 1 46 -1 M END