IFLAB-ZINC02458618 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.1420 -0.6650 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -0.0500 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.3290 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 2.0720 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 3.5520 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 4.1380 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -0.8630 -0.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3780 -1.8410 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0900 -1.0370 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 0.2280 1.8710 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 1.0430 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 2.0330 1.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 0.7900 -0.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 -0.1490 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 -0.4200 -2.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 1.9130 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5490 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 1.8260 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 -1.3330 2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -1.8080 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5450 0.4810 2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0250 1.2910 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 4.2490 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 5.2130 0.0270 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 18 1 0 0 0 0 2 3 2 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 5 20 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 2 0 0 0 0 25 26 1 0 0 0 0 M END