MMs00041268 MOE2007 2D CORINA 3.40 0006 02.08.2006 66 69 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 1.3376 -0.6789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4184 -2.1767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -2.8556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0127 -2.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9319 -0.5388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5943 0.1401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5134 1.6379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1886 0.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1077 1.7779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3645 2.5969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7020 1.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7829 0.4202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5262 -0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0039 -0.4511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7496 -1.9294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4459 -0.0379 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5846 -1.0143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8651 -0.2330 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.8651 -1.4330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5177 1.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0231 1.3481 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6231 2.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3007 2.6626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1709 3.8844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8222 2.9156 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2498 -0.8096 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.4416 0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2486 1.5888 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8263 -0.4755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0181 0.4354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8251 1.9229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2099 1.3463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4028 -0.1413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5957 -1.6288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4039 -2.5397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5431 1.0701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0701 0.5431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5431 -1.0701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4131 -2.8319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8207 -4.0538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0828 -2.5798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7117 1.7026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4487 2.8361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3152 1.5732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0377 2.3210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2998 3.7951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5909 -1.5970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7126 -1.8386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3133 -1.9677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7078 1.3803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4893 2.4259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4916 4.0692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4041 -1.9997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1796 -1.4863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7095 -1.2879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0152 2.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6708 3.1130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6351 1.7686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9385 0.3928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1633 2.0749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4812 2.2997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6648 1.0298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6015 -0.1959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9804 -2.2055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1348 -3.3955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 48 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 35 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 35 36 2 0 0 0 0 35 65 1 0 0 0 0 65 66 1 0 0 0 0 M END