CHEMBRIDGE-ZINC02863109 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -0.7820 -2.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -0.6000 -1.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 -1.0490 -2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 -1.1910 -2.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 -1.6290 -3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4850 -1.8690 -4.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -1.5000 -3.8480 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -0.6320 0.0150 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -0.0810 1.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 -0.5330 1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -0.2940 2.8880 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 0.1920 3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7540 -0.8510 2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7050 -0.8340 3.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -1.4290 1.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4400 -1.9080 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4370 -1.2040 0.9210 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -0.3670 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 -1.7820 -3.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -2.2300 -5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -0.5110 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 1.0070 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 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 25 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 21 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 M END