IFLAB-ZINC00065180 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 0 0 0 0 0 0999 V2000 0.0800 1.5220 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -0.0120 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.6370 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 -0.3560 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -0.5490 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -0.3470 -1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 -0.8440 -2.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -1.5360 -3.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -1.6960 -3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -1.2230 -2.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2280 -0.6370 -2.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 0.0050 -1.7720 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1200 1.8440 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 1.9920 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 1.9290 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -0.3020 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -1.7320 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -0.3660 1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 0.0780 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 -1.4400 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 0.0300 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 0.1950 -0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -1.9410 -4.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -2.2280 -3.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 -1.1200 -3.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 25 2 0 0 0 0 M CHG 1 12 -1 M END