MMs03965815 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 0.7456 -1.3016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2455 -1.3067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2455 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4911 -2.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9911 -2.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2367 -3.9048 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.7455 -1.3221 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7506 0.1779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7404 -2.8221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2455 -1.3273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9911 -2.6288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4911 -2.6340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2455 -1.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0359 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8999 1.0033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2544 1.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5088 2.5621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7544 1.2554 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5088 2.5519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0088 2.5468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7544 1.2452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9999 -0.0513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4999 -0.0462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0413 0.5964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5964 1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0413 -0.5964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4035 1.0310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1035 1.0218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0875 -3.6547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8620 -3.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1954 -3.8113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2786 -3.8150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6173 -3.0483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1621 -2.1120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7064 -0.9534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8737 0.3835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2124 1.1503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3826 2.9662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7212 3.7329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8045 3.7292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1378 2.9533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6762 2.0134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6710 0.4707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1261 -0.4656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7875 -1.2324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9354 -0.2495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7043 -1.2287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 M END