MMs01776285 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 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 1.3427 -0.6686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4351 -2.1658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7778 -2.8344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0282 -2.0058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9359 -0.5087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5931 0.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3710 -2.6744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6214 -1.8459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0267 -2.3705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4283 -3.8157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9598 -1.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1313 0.0543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6559 1.4596 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.6860 -0.3473 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.4584 -1.2608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2637 0.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7623 -0.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4556 -1.3901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5676 1.2056 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0662 1.1409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9994 2.3153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4047 1.7907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3400 0.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8948 -0.1095 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 18.6055 -0.5132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9357 0.1801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0004 1.6787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7349 2.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5978 3.7605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6486 4.8310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1454 4.1354 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5349 1.0742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0742 0.5349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5349 -1.0742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4348 -2.8286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8517 -4.0321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9362 0.1542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5193 1.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4448 -3.8722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1993 -2.4325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5673 -1.7194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1548 0.4634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5229 1.1764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0130 2.2697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7953 -1.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3365 -1.4649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2971 -0.9642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1253 0.3373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1720 1.4196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4590 2.7876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0039 3.4357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5451 3.3692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8241 5.2916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3048 3.2790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 30 1 0 0 0 0 23 24 2 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M END