MMs01938089 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 37 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 0.0036 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2936 -2.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -3.7531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0108 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3081 -3.7469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3045 -2.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6017 -1.4937 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9025 -2.2406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9061 -3.7406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1997 -1.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5006 -2.2344 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7978 -1.4812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9510 0.0109 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4219 -3.2612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4175 0.3263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1706 -0.9709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1696 -2.0880 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6706 -0.9673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4175 0.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6643 1.6308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1644 1.6272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.9175 0.3372 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.5872 -4.5062 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0029 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3343 -1.6556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0137 -5.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3487 -4.3444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5988 -0.2937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4262 -0.5701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9689 -0.5664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2731 -2.0051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2618 2.6715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 22 2 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 19 20 1 0 0 0 0 19 34 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 35 1 0 0 0 0 M END