PUBCHEM-ZINC02149479 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 0.0550 2.3120 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 2.4410 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 1.8780 -1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 1.1840 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 1.0740 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 1.6380 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 0.4250 1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 0.4880 1.5990 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6950 0.5850 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 1.2170 -1.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -0.7600 -0.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 -1.4570 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 -2.9520 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 -3.5230 -2.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 -4.9180 -2.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 -5.4940 -3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7770 -5.7810 -4.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -6.3000 -5.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -6.3900 -5.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 -6.6130 -6.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -5.9280 -7.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1490 -6.1280 -8.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 -7.0110 -8.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2540 -7.7080 -7.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2680 -7.5340 -6.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3340 -8.3670 -4.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -8.6830 -4.3030 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8860 2.7440 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 2.9750 -1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 1.9730 -2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 1.5600 2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9900 -1.2620 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6630 -1.0920 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6200 -3.4380 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 -3.1270 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 -5.4420 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -5.0180 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 -6.4330 -2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -4.7800 -3.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -5.2300 -7.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 -5.5950 -9.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9650 -7.1690 -9.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0680 -8.4110 -6.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 -0.1010 2.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4910 -8.7250 -4.4650 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 44 2 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 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 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 45 2 0 0 0 0 M CHG 1 8 -1 M CHG 1 27 -1 M END