MMs01177124 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 57 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 -0.4929 -1.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9662 -1.6982 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6556 -0.5391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6045 -3.0557 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0927 -2.8681 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2518 -2.5576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3742 -1.3948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -0.6718 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1192 -3.9619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6852 -5.3978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5796 -3.6198 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6061 -4.7136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0666 -4.3715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0931 -5.4653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5536 -5.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8814 -4.3699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6581 -5.6532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3817 -4.4009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3949 -3.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8946 -3.1485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6176 -4.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -5.7461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3413 -5.7151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -7.0603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7874 -8.3436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1173 -4.4937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8403 -5.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6712 -1.8652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1709 -1.8962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1334 -0.3943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3943 1.1334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1334 0.3943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6918 -1.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4757 -2.6166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5229 -1.7420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8396 -0.2887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9268 -2.4712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6018 -5.3704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0785 -5.8167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5942 -3.2684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0709 -3.7148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2799 -3.9548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7219 -4.8496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8272 -6.2916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1835 -2.0662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -6.7417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7607 -7.7223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -9.3702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 -8.9649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7889 -6.3864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4188 -6.8594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8917 -5.2295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1461 -3.0959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3707 -1.9210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1957 -0.6965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 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 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M END