MMs02212688 MOE2007 2D CORINA 3.40 0006 02.08.2006 30 30 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 -0.8212 -1.2552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3189 -1.1716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1402 -2.4268 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.9614 -3.6820 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8849 -3.2481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9686 -4.7457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7133 -5.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3954 -1.6056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7342 -2.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8178 -3.7797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1566 -4.4561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4118 -3.6348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3282 -2.1372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9894 -1.4608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9058 0.0369 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -9.7507 -4.3113 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0042 -0.6570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 1.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0042 0.6570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2818 -1.7279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0952 -2.4235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1369 -4.4718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4412 -5.8487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3703 -6.5711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2908 -6.2240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0563 -4.5628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8136 -4.4367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2235 -5.6542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3324 -1.4802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 M END