MMs01264478 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 59 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 1.4656 -0.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5855 0.6786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8806 -0.0781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5612 -1.5437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0687 -1.6928 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -2.9880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -2.9803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9313 -1.6774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4313 -1.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1879 -2.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4446 -4.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9446 -4.2755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -5.3773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8212 -4.7602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6567 -3.2692 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5592 -2.6635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2541 0.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4185 2.0159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4630 -0.3629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8365 0.2401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0455 -0.6477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8810 -2.1387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4189 -0.0447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5833 1.4463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9568 2.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1658 1.1614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0013 -0.3295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6279 -0.9326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4634 -2.4235 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6724 -3.3114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5392 1.7645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1212 3.5403 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.2555 1.1725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1725 0.2555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2555 -1.1725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4661 1.8726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4375 -3.4042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0976 -4.1687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -0.6413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0259 -0.6274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -5.3178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1979 -5.8995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9937 -4.5047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6633 -3.4619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3576 -3.5594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4551 -1.8652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5956 -1.1921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1290 -1.3612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6161 2.1566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9685 -1.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9621 -4.2786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6396 -4.0217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3827 -2.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5064 1.0542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6707 2.9573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 33 1 0 0 0 0 27 28 2 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 M END