MMs01418621 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 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 1.2937 0.7592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2831 2.2591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5768 3.0183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5661 4.5183 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7734 5.4085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2428 5.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2386 6.2289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7649 7.6521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2956 7.9536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2998 6.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7998 6.8212 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3464 5.3913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0769 4.9177 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1987 5.9135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6219 5.4399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9234 3.9705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7437 6.4357 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1670 5.9621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3867 6.8351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5940 5.9449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1204 4.5216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6204 4.5322 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.1161 3.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5855 3.7013 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.7446 4.0119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0591 5.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0634 6.2463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5813 2.5795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3973 8.3351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1037 9.0943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7017 9.0759 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7607 8.7739 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8825 7.7781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6389 9.7697 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7565 9.8957 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6073 1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -0.6073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6073 -1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7121 -0.3655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 0.9759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1028 2.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8647 3.3838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9952 1.8936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 3.2351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6217 3.9685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4141 5.9877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9167 9.0922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2583 6.6590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7695 6.9690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5025 7.6112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0940 2.7711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5578 2.2840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1147 4.5537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8046 6.0649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6217 7.3621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0855 6.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4787 3.3761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3779 1.6820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6839 1.7829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7102 10.2758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7366 8.4685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9320 9.6545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3776 11.0343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 48 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 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 51 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 30 1 0 0 0 0 21 22 2 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 29 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 33 34 2 0 0 0 0 33 35 2 0 0 0 0 33 36 1 0 0 0 0 36 63 1 0 0 0 0 36 64 1 0 0 0 0 M END