MMs01938110 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 1.2930 0.7604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 2.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 3.0207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 4.5207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 5.2602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 2.2395 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 2.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 4.4791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9150 2.2187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 2.9583 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.5130 2.1979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6578 0.7049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1470 3.9688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1225 0.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8829 1.6743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8882 2.7970 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3828 1.6623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1224 0.3573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3620 -0.9357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8621 -0.9237 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.6224 0.3453 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6083 1.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0344 -0.6083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6083 -1.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -0.4396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0063 -1.0232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 -0.5709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1897 1.0648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 2.4290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5964 5.1290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2474 6.4602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 5.0915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3074 1.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1363 1.3057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6790 1.2933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9911 2.6967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9537 -1.9797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 24 2 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 M END