MMs01452852 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0125 -1.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3177 -2.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2803 -2.2607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5855 -1.5216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7547 -0.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6484 0.9818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2245 0.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8459 1.6337 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9636 -1.0367 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9507 -2.1430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2504 -3.6128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4541 -1.2059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3458 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7471 1.3756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8362 -0.1689 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7280 1.0372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1293 2.4126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0210 3.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5114 3.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1101 2.0742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2184 0.8680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6006 1.9050 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -12.4032 4.6557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2949 5.8618 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0517 -0.8999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7264 -3.2833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3619 -2.8305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -1.1949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5013 -3.1735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 -3.1864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1137 -2.3566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5282 -1.7409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3152 -1.2692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9369 2.5479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5421 4.7190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6974 -0.2322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 40 1 0 0 0 0 24 25 3 0 0 0 0 M END