MMs00217312 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 54 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 0.7612 -1.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0224 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7836 -3.8905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2835 -3.8776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0223 -2.5721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2611 -1.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5222 -2.5592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2834 -3.8517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5446 -5.1572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3058 -6.4497 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0447 -5.1701 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4536 -6.2145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7833 -3.8388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5221 -2.5334 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7609 -1.2408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4997 0.0646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7386 1.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4773 2.6626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9773 2.6755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7384 1.3830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 0.0776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0221 -2.5204 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0091 -1.0205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0350 -4.0204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5220 -2.5075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2608 -1.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7607 -1.1891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5219 -2.4817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7831 -3.7871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2832 -3.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5444 -5.1055 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 0.6089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6089 1.0340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -0.6089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1776 -2.6083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1925 -4.9349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8521 -0.2352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1132 -1.5148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5851 -5.0223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9145 -4.2395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8484 -2.0201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8351 -0.4774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5386 1.3468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8684 3.6966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5683 3.7199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6086 -0.9565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6518 -0.1680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3517 -0.1448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7218 -2.4713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3920 -4.8211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 14 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 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 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 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 M END