MMs01048305 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 1.1289 -0.9877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -2.4592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9669 -3.4469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3867 -2.9631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6776 -1.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5487 -0.5039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 -1.3136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7966 -2.6751 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6963 -3.6946 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8985 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3983 0.0174 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1297 1.3270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3613 2.6152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6296 1.3483 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3610 2.6579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8608 2.6793 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.2608 3.7185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7251 3.9052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1582 3.4621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1796 1.9622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7597 1.4784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7902 0.9031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9031 0.7902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7902 -0.9031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2979 -2.8463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7341 -4.6242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7815 0.6733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7651 0.3903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0900 1.1806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0130 -1.0132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2443 0.3177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2276 3.0522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5525 3.8425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6775 4.4904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1976 5.0083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3909 4.6393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3533 3.3537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3711 2.1047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4457 0.7921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 M END