MMs02388828 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 67 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 -1.5000 0.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2556 -1.2894 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5111 -2.5916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -3.8874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0112 -2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5844 -3.6398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7444 -1.3022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2444 -1.3087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7555 -1.2829 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1555 -0.2437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6320 -0.0656 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4805 0.7829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0606 -0.5230 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2197 -0.8336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0670 -2.0230 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7564 -3.1821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6424 -2.4927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2843 -2.8995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6520 -2.2835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8693 -3.1600 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 -10.7457 -1.9427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0866 -4.0364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4543 -3.4204 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.4543 -4.6204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7598 -1.9519 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -13.3598 -0.9127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2509 -1.7887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.8669 -3.1564 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -15.1775 -4.3155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7565 -4.1649 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -13.1565 -5.2041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9197 -5.6560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.3355 -3.4620 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.9514 -4.8296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.4425 -4.6664 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -18.7481 -3.1979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.4459 -2.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.4394 -0.9535 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -18.7352 -0.1979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.0375 -0.9423 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -20.0439 -2.4423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.3462 -3.1868 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.7514 -0.8415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2088 0.5871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2703 0.3638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1624 1.3589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6045 1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0955 1.0482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4247 -3.7368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9596 -3.8914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0180 -6.1393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3559 -5.8714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.7301 1.0021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -22.3828 -2.5823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.3513 -4.3867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3840 -1.3159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6894 -0.2827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4020 1.4754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1397 1.5567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9615 2.2542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9928 -4.3773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4856 -5.4714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 8 1 0 0 0 0 1 48 1 0 0 0 0 2 3 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 47 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 46 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 21 62 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 44 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 34 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 33 52 1 0 0 0 0 34 35 1 0 0 0 0 34 38 1 0 0 0 0 35 36 2 0 0 0 0 35 53 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 37 42 2 0 0 0 0 38 39 2 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 40 54 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 55 1 0 0 0 0 43 56 1 0 0 0 0 44 45 1 0 0 0 0 44 57 1 0 0 0 0 44 58 1 0 0 0 0 45 59 1 0 0 0 0 46 60 1 0 0 0 0 47 61 1 0 0 0 0 62 63 1 0 0 0 0 M END