MMs01951353 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 63 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 1.5000 0.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2553 -1.2897 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0553 -1.2897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5107 -2.5919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2661 -3.8878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7553 -1.2835 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7446 1.3269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2131 1.0211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4230 1.9078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7958 1.3033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9587 -0.1878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3760 -0.4700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0082 -1.0858 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.3316 -0.7923 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6495 -2.2582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1419 -2.4088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7463 -1.0360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6275 -0.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0057 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8427 3.6811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4699 4.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2600 3.3989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5832 5.4954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0743 5.6584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9892 2.6228 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4892 2.6166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7446 1.3145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2867 1.1871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6259 0.4213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5883 -1.8243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5946 -3.3670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6704 -4.9295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3596 -2.3203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4566 -2.3885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6544 -3.4582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8972 -3.5836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2847 -2.7749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7880 -1.6317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4477 -0.0623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2728 0.4471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5159 0.7697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2709 1.6518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1578 2.5255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1079 3.0634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9948 3.9371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5511 6.2048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8739 6.4633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0992 5.1408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1726 5.1748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5579 6.7566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9761 6.1419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 3.6534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7489 -1.0745 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 30 2 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 22 1 0 0 0 0 14 17 1 0 0 0 0 14 59 1 0 0 0 0 15 16 1 0 0 0 0 15 59 2 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 M END