PUBCHEM-ZINC04117396 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.0310 1.4630 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 0.0810 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -0.5980 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 0.1060 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 1.4880 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 2.1670 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -0.6340 -0.0260 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6020 -1.6500 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 -0.6830 -1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 -1.5030 -1.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1830 -1.6960 -2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6620 -1.1810 -3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 -1.3750 -5.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5330 -2.0840 -5.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0490 -2.5950 -3.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3820 -2.3990 -2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9410 -2.9430 -1.4620 N 0 3 0 0 0 0 0 0 0 0 0 0 9.1440 -2.9310 -1.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1970 -3.4030 -0.6140 O 0 5 0 0 0 0 0 0 0 0 0 0 5.8170 -0.8590 -6.2630 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 -1.7750 -7.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6960 -2.1130 -8.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8050 -0.9260 -7.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3600 -0.6360 -6.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 0.0410 0.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 1.9930 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -0.4690 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -1.6780 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 2.0380 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 3.2460 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -1.1190 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 0.3270 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8390 -1.9120 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 -0.6310 -3.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0600 -2.2350 -6.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9780 -3.1460 -3.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7020 -1.2890 -8.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5440 -2.6860 -7.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 -2.1510 -9.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3140 -3.0540 -7.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 -0.0660 -8.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -1.2200 -7.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -1.3240 -5.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 0.3960 -5.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 0.9530 0.5460 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END