PUBCHEM-ZINC04154533 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 0 0 0 0 0 0999 V2000 0.4590 1.1110 -0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.3160 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.7690 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -0.4300 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 0.5650 0.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -1.7460 0.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 -2.2520 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 -3.5970 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9210 -3.8590 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6210 -2.6520 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 -1.2910 0.2400 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.1090 -2.4130 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7360 -2.7520 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1990 -3.2230 1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3530 -4.7520 1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1170 -5.3360 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6920 -6.8060 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0390 -7.2590 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5040 -7.1620 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8970 -5.7510 -1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5660 -5.2270 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 -4.5830 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -5.8110 -0.2460 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5480 1.1710 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 1.4470 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 1.8140 0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -0.9730 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -0.1640 2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -1.8130 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -0.6840 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -2.5220 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3390 -1.3650 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5580 -2.9760 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1410 -3.4860 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7060 -1.8380 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6970 -2.8960 2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7270 -2.7370 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6810 -5.2110 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3710 -5.0180 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0330 -5.2360 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3610 -4.7690 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0120 -7.0040 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5890 -7.4110 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2900 -8.3190 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4750 -6.7280 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0690 -7.7610 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1930 -7.6510 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9640 -5.7920 -1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5470 -5.0550 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9250 -5.9390 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4700 -5.1860 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 -4.1080 -0.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 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 31 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 2 0 0 0 0 M CHG 1 23 -1 M END