MMs02447726 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 41 0 0 1 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 1.2991 0.7498 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3384 1.3498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0003 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6373 -0.6003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5979 -1.5003 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5979 -2.7003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8969 -2.2505 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9361 -2.8505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -1.5006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4949 -2.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5342 -1.6509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8967 -3.7505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9358 -4.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2988 -2.2502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2986 -3.4502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8972 0.7495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8973 1.9495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2993 2.2498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2601 2.8500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8482 -1.2988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5984 -2.5978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9985 -3.6371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8972 -0.7495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1962 0.0006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2355 -0.5993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3479 1.2994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5978 2.5984 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7712 -0.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3857 -0.4596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4247 -0.5813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -0.5814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3886 -0.9132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9291 -2.0703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 -1.6689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6687 -1.6687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2673 0.5282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2671 2.0709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 0.7502 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5275 1.6693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0702 1.6695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 17 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 15 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 21 28 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 28 38 1 0 0 0 0 28 39 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 M CHG 1 29 -1 M CHG 1 40 1 M END