PUBCHEM-ZINC02572326 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0560 1.6850 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 0.1680 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -0.3650 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -1.8910 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -2.4230 2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -3.9260 2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -4.5590 2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -5.9550 2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 -6.7690 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -6.1190 2.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -4.7210 2.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -6.7600 3.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -8.1550 3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -8.8770 2.6760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4190 -8.6750 1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 -8.2830 2.3640 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3380 -8.5960 3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -8.8940 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -10.1410 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -11.0190 1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -10.4030 2.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -10.7270 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -10.0600 -1.2070 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3600 -8.2760 5.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -8.6680 4.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -6.4450 1.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 2.1450 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 2.0440 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 2.0260 0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -0.2600 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -0.1410 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 0.0690 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.0500 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -2.3250 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -2.2070 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -1.9880 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -2.1060 3.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 -3.9740 1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -4.2590 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -8.3140 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -11.2220 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -11.9850 1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -10.6480 3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -10.8760 3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -7.7130 5.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -9.3180 5.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -7.8530 5.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -8.6160 3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -9.6970 4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 -8.0390 4.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 -7.3850 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 -11.8130 -1.0220 O 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 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 52 2 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 M CHG 1 23 -1 M END