MMs01214565 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 58 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 0.0028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2476 1.3032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7476 1.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7524 -1.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2524 -1.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5048 -2.5897 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3457 -2.9003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9969 -2.7438 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3115 -4.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6829 -4.8180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0138 -4.9628 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9746 -5.5628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8972 -3.9612 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8598 -6.4549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9985 -1.6272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4663 -1.9364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4679 -0.8198 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0018 0.6059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0034 1.7225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5340 0.9151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9357 -1.1289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4019 -2.5547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9374 -0.0124 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4052 -0.3215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4068 0.7951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8713 -1.7472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0022 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0022 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6457 2.3413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3457 2.3463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 0.0105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6543 -2.3352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6661 -6.3317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 -7.6486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0534 -6.5781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9797 -0.9932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2222 -1.0705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0188 -3.0498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4851 -2.5704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6912 1.7650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8967 0.9212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8047 2.6158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1101 2.5238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7813 2.0893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3597 1.1624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4103 0.3280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5644 1.1282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5643 -0.6321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3000 -0.0063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2081 1.6883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5135 1.5964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7307 -2.1202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2442 -2.8878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0119 -1.3743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 M END