MMs01282970 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 1.4948 0.1247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2725 1.4073 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7327 1.0640 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8574 -0.4308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4743 -1.0113 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 -2.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6948 -2.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3981 -1.8769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8343 -2.3096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1776 -3.7698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0847 -4.7972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3515 -4.3644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1401 -1.2085 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4549 -0.4866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7375 -1.2643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7053 -2.7639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0524 -0.5424 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3350 -1.3201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3028 -2.8197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5854 -3.5975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9003 -2.8756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9325 -1.3759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6499 -0.5982 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1829 -3.6533 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0998 1.1958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1958 -0.0998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0998 -1.1958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3291 -2.5391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2725 -3.6631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1234 -0.7087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7086 -1.4877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3266 -4.1160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3594 -5.9654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2258 -5.1864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7035 0.4490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2458 0.4159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0782 0.6574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2509 -3.3973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5597 -4.7972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9844 -0.7984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 M END