MMs01266661 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 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 1.4192 0.4858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 1.9577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5494 -0.5003 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 -0.0145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2575 1.4574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6766 1.9432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8069 0.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5180 -0.5149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0989 -1.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2261 1.4429 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.3564 0.4567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7755 0.9425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0644 2.4144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9058 -0.0436 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3250 0.4422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6138 1.9141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0330 2.3999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1633 1.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8744 -0.0581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4552 -0.5439 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.5824 1.8996 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3886 1.1353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1353 -0.3886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3886 -1.1353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3184 -1.6779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3532 2.2463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9077 3.1207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4223 -1.3038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8678 -2.1782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4224 -0.2968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9362 -0.5939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6747 -1.2211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7096 2.7030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2641 3.5774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7786 -0.8470 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 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 9 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 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 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 M END