PUBCHEM-ZINC05836022 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -1.9260 -1.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -2.7880 -2.4450 P 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -2.0820 -4.0950 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -2.7300 -2.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -1.5470 -2.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 -0.5230 -1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 0.6780 -2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 0.8590 -3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -0.1600 -4.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9630 -1.3650 -4.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 2.1470 -3.9000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4160 3.0460 -3.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 2.3070 -5.0570 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9210 -4.3170 -2.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -4.5160 -2.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 -4.8210 -4.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -5.0230 -4.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -4.9220 -3.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 -4.6180 -2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -4.4200 -1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3420 -5.1380 -4.0900 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5620 -5.4050 -5.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2660 -5.0480 -3.3010 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 -0.6640 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 1.4760 -1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8210 -0.0160 -5.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -2.1620 -4.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -4.9000 -4.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -5.2610 -5.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 -4.5380 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -4.1870 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M CHG 1 24 1 M CHG 1 26 -1 M END