MMs01962221 MOE2007 2D CORINA 3.40 0006 02.08.2006 31 33 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 -0.7611 -1.2926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0222 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4778 -2.6108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2388 -1.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4999 -0.0128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7033 -1.6426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8474 -3.1357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4719 -3.7340 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2124 -4.9056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8266 -0.6484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5272 0.8214 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2492 -1.1241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3724 -0.1300 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3665 -1.2532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3783 0.9933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4956 0.8642 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9182 0.3885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1392 1.2598 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3452 0.3677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8695 -1.0548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3695 -1.0420 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5911 1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 -1.2823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -3.6321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1088 1.0213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8815 -3.7445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4886 -2.3000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2562 2.0400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4896 0.7288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5665 -2.0316 0.0000 H 0 0 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 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 28 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 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 30 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 M END