MMs01401683 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 -0.7501 -1.2990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0002 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4998 -2.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2498 -3.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4997 -5.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0003 -5.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7502 -3.8971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2502 -3.8970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0002 -2.5979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0003 -5.1960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5003 -5.1959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2502 -3.8968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7502 -3.8967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5003 -5.1957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7504 -6.4948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2504 -6.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0003 -5.1956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8821 -6.4091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3086 -5.9454 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.7352 -6.4089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6169 -5.1953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7351 -3.9818 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.3085 -4.4454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8819 -3.9820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2496 -6.4953 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0392 -0.6001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6001 1.0392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0392 0.6001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0999 -1.5590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4498 -3.8973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6004 -6.2353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4004 -6.2352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6502 -2.8576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3502 -2.8574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3505 -7.5340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6505 -7.5341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5113 -7.5504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1061 -7.5501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8169 -5.1952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 26 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 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 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 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 M END