MMs02526777 MOE2007 2D CORINA 3.40 0006 02.08.2006 65 68 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 1.4999 -0.0127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 1.2799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 2.5852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7609 1.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5219 2.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0219 2.5470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7608 1.2416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 -0.0382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7387 -1.3564 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1299 -2.3904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2387 -1.3691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9776 -2.6745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0765 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2607 1.2289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0218 2.5215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4996 -0.0892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2386 -1.3946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7385 -1.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4774 -2.7127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9774 -2.7254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7163 -4.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9553 -5.3234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2163 -4.0436 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.9552 -5.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4551 -5.3617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2162 -4.0691 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.4772 -2.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9773 -2.7509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7161 -4.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4550 -5.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9550 -5.3999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7160 -4.1073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9771 -2.8019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4771 -2.7892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.2159 -4.1200 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0102 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0102 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9308 3.6040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6307 3.5811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 -1.0723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3013 1.0943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6307 0.3116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1075 -1.7954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4369 -2.5781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5402 -0.2238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8696 -1.0065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3464 -3.1135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6758 -3.8962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7791 -1.5419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1085 -2.3246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8241 -5.7497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1535 -6.5324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2367 -6.5416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5792 -5.7817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6083 -2.3629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2789 -1.5802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8532 -2.3309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1957 -1.5710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8462 -6.4213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.5461 -6.4442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.5859 -1.7678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8860 -1.7449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 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 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 62 1 0 0 0 0 33 34 1 0 0 0 0 33 63 1 0 0 0 0 34 35 2 0 0 0 0 34 37 1 0 0 0 0 35 36 1 0 0 0 0 35 64 1 0 0 0 0 36 65 1 0 0 0 0 M END