PUBCHEM-ZINC05059453 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 0.4070 2.3440 -1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 1.3500 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 0.3590 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 0.3610 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 1.3630 -1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 2.3510 -1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 1.3660 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 0.4450 -1.0040 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1070 -0.6020 0.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -1.6990 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -2.1360 1.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -2.4330 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3970 -1.7560 1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6120 -2.4360 1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6630 -3.7880 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4890 -4.4530 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 -3.7900 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5790 -6.1640 0.5750 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3240 -6.5770 -0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8410 -6.3890 -0.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 -6.8570 2.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5770 -6.8670 3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0030 -6.1630 4.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 -6.2490 5.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 -7.6940 5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 -8.4050 4.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 -8.3180 3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 3.1140 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 1.3450 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -0.4050 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 3.1280 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 -0.4120 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3690 -0.6930 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5170 -1.9070 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6160 -4.3110 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -4.3020 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5980 -7.2650 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -6.3350 2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9270 -6.6120 4.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 -5.1100 4.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -5.7930 6.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -5.6710 5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -8.2350 6.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -7.7140 6.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 -9.4560 4.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -7.9550 3.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -8.7850 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 -8.9000 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 2.2640 -2.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 49 2 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M CHG 1 8 -1 M END