MMs02138765 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 35 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 -0.7598 1.2933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2598 1.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2401 -1.3160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7402 -1.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9803 -2.6207 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0340 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2597 1.2593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7596 1.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6505 2.4548 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0735 1.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0622 0.4805 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6321 0.0278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2937 2.8529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1482 4.3459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3683 5.2183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7340 4.5979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8795 3.1049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6593 2.2325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9541 5.4703 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1677 2.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8676 2.3166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1323 -2.3393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1802 -2.6298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3724 -3.6554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1352 1.6782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4770 2.4394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0556 4.8422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2519 6.4127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9720 2.6086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7757 1.0381 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 M END