MMs02438245 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 62 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 -1.2930 0.7604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 2.2603 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 4.4999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 2.2395 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 0.7396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 3.0207 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7255 3.8692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9492 2.4216 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1006 1.5730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9439 3.5443 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5439 4.5835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1835 4.8373 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3350 5.6858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7189 4.5137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7827 6.2124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8913 7.4189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3706 8.5190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4369 3.3994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1344 4.3758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2727 0.9569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7030 0.5048 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -6.1551 1.9350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1332 0.0527 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4568 -1.4120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8871 -1.8641 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.0386 -2.7126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3620 -3.2869 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.9620 -4.3262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8620 -3.2749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3141 -1.8447 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -11.3141 -0.6447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0935 -0.9727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.7369 -1.3698 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.0370 0.0999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4598 0.5748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5825 -0.4199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.0054 0.0550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.2824 -1.8896 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.1806 -2.6854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8596 -2.3645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5595 -3.8342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4901 -4.5075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9869 -5.5998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0096 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 0.1687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5884 -1.2207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 0.5709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7828 5.5494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6093 7.0823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2579 -1.4635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2993 -2.6016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7461 -4.4693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0377 -3.5150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1388 0.8957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6999 1.7506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2509 -0.9255 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 7 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 49 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 24 59 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 35 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 45 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 36 37 1 0 0 0 0 36 43 1 0 0 0 0 37 38 2 0 0 0 0 37 57 1 0 0 0 0 38 39 1 0 0 0 0 38 58 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 43 44 2 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 59 -1 M END