NCID-ZINC05411754 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.6860 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1480 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7510 0.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.8940 2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.2060 3.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -2.9080 4.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -4.2910 4.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -4.9800 3.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -4.2900 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -6.4600 3.6250 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1410 -7.0700 4.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -7.0670 2.5690 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0000 -0.7330 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -1.5400 -1.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -2.2190 -2.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.1040 -3.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -1.3080 -3.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -0.6180 -2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -1.1920 -4.2730 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2180 -1.7970 -5.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -0.4920 -3.9790 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.1510 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -1.1260 3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -2.3760 5.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -4.8360 5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.8280 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -1.6310 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -2.8430 -3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -2.6390 -4.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 0.0070 -1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 6 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 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M CHG 1 21 1 M CHG 1 23 -1 M END