IFLAB-ZINC04275779 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3210 0.0090 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 1.6500 -0.6050 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 0.9680 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 1.9080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 3.3530 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 3.7760 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 4.2130 0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 1.2580 -0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 0.2580 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 -0.9000 -0.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9930 0.5640 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3880 1.8450 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6950 2.1840 -0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6320 1.1600 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2330 -0.1270 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8920 -0.4590 -0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -0.6290 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 3.8760 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 5.1700 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 2.1810 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 2.6260 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6360 1.4600 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6030 0.9920 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2800 0.0340 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9070 -0.9360 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 3 4 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 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 M END