MMs02221158 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 0.9833 -1.1328 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4559 -0.8476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9453 0.5703 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1587 1.4766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4179 0.8555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9073 2.2734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4012 -0.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9119 -1.6952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4392 -1.9803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8951 -2.8279 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3678 -2.5428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8571 -1.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8739 0.0079 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3298 -0.8397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3131 -1.9724 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7857 -1.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7690 -2.8200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2417 -2.5348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7310 -1.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7477 0.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2751 -0.2693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2036 -0.8317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6930 0.5862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1869 -1.9645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.6596 -1.6793 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 18.3490 -2.8384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1489 -0.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6216 0.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1109 1.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1276 2.5745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.6429 -2.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1155 -2.5269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9062 0.7866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7866 0.9062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9062 -0.7866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5918 -2.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1544 -3.4490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9005 0.2809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3588 -0.2223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9216 -3.1068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3775 -3.9544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0283 -3.4410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1392 1.1502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4884 0.6369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7955 -3.0988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9638 -0.0728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1288 0.9384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6417 -1.1761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8067 -0.1648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.5836 1.7269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.1535 -4.2300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9401 -5.1362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.9751 2.8612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 10 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 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 46 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 32 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 32 33 2 0 0 0 0 32 52 1 0 0 0 0 51 54 1 0 0 0 0 52 53 1 0 0 0 0 M END