MMs02114613 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 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 -0.7606 1.2929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2606 1.2806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2393 -1.3174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7393 -1.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4998 -0.0369 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2605 1.2560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5211 2.5611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7604 1.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4997 -0.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7391 -1.3543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9997 -0.0737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8913 1.1326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3140 0.6574 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.3017 -0.8426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8714 -1.2944 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.5080 -1.7342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.8833 -1.1353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0523 0.3551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4275 0.9540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6338 0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4648 -1.4280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0895 -2.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.6711 -2.3196 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -18.0091 0.6613 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1691 2.3370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8691 2.3148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8308 -2.3615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1308 -2.3394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0913 -1.0810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3689 2.2780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1296 3.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5298 2.2768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3728 -2.9265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0873 1.0684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5628 2.1463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9543 -3.2193 0.0000 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 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 35 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 39 1 0 0 0 0 M END