PUBCHEM-ZINC01854854 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.1120 1.0830 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 0.6580 2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 2.9640 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 3.3970 2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 4.9260 2.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5950 5.3800 3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 5.5990 3.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8350 6.0000 4.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 6.1830 5.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 5.9690 5.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 5.5630 4.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 5.3590 5.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 5.0740 4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 5.5480 6.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 5.3660 6.8190 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 5.5660 8.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 5.4080 8.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 5.9590 9.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 6.0870 10.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 6.1910 8.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 6.5330 9.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 5.9810 7.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 6.1700 7.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 0.0070 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 1.3450 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 1.6270 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 0.9670 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -0.4000 1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 0.8290 2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 3.4320 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 3.2280 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 2.9830 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 3.0020 3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 5.3610 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 5.3260 1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 5.4600 2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8860 6.1710 4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0460 6.4950 6.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 1.4660 0.9550 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7680 1.2030 0.8490 H 0 0 0 0 0 0 0 0 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 1 39 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 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 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 39 1 M END