PUBCHEM-ZINC05946241 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0030 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -0.6800 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0360 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4360 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0960 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -0.6760 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 0.0220 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0800 -0.6590 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2700 0.0550 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4240 1.5180 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5360 2.3520 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7560 1.7420 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3960 0.5240 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5300 -0.4570 -0.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8620 0.3470 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7010 1.4580 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0700 1.2860 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6110 0.0160 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7860 -1.0890 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4160 -0.9310 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3800 2.9980 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6970 3.5860 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3120 4.8230 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6120 5.4780 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2990 4.8980 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6870 3.6550 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3830 3.0810 -2.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2700 6.8040 0.0890 N 0 3 0 0 0 0 0 0 0 0 0 0 11.5460 7.3160 1.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5350 7.3820 -0.9500 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5540 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -1.7600 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 1.9960 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1760 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -1.7560 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 1.1010 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 -1.7380 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2790 2.4490 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7200 2.1430 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6840 -0.1130 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2150 -2.0770 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7730 -1.7930 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4640 3.0770 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5590 5.2800 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5340 5.4120 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5040 3.3080 -2.7280 H 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END