MMs03518409 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 -0.7546 1.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2546 1.2911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2454 -1.3070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7454 -1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2454 -1.3176 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8454 -2.3568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4908 -2.6140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2362 -3.9157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7454 -1.3229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3417 -2.3643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 -0.0265 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2036 0.7281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7963 -0.7811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2545 1.2698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7545 1.2645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4999 -0.0372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9999 -0.0425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7453 -1.3441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9907 -2.6405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4907 -2.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7453 -1.3335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1583 2.3377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8583 2.3282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5435 -1.8277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1417 -2.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2958 1.1666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6290 0.3905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6582 2.3112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3582 2.3016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6036 0.9946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9453 -1.3484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5870 -3.6819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8871 -3.6723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5453 -1.3293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9908 -2.6087 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 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 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 M CHG 1 39 -1 M END