MMs02001899 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.2531 -0.8244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3228 -2.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7693 -2.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4424 -4.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9398 -4.1475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7642 -2.8943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0912 -1.5538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5937 -1.4664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6567 -0.2951 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9741 0.8621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1515 -3.2598 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2457 -2.7140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -3.6511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8141 -3.1052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9854 -4.0423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7595 -5.5252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3826 -3.4964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6085 -2.0135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0056 -1.4677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1769 -2.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9510 -3.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5539 -4.4335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3280 -5.9164 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.2315 0.0152 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.6286 0.5610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0602 0.9522 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6595 1.0025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0025 0.6595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6595 -1.0025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7829 -5.0626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4783 -5.2199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9622 -2.9642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7507 -0.5513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6215 -1.6891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1466 -1.9214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -4.4437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0411 -4.6760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9948 -1.9189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6714 -1.2639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2946 -1.9681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8881 -4.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 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 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END