MMs01656071 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 58 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 1.4941 0.1328 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8941 -0.9064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3562 -1.0947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8503 -0.9619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4823 0.3985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6202 1.6260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5213 2.8252 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9403 2.3388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9162 0.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 0.0683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1789 -1.4316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5139 0.7973 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5380 2.2971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2512 3.0679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8007 0.0265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1117 0.7556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1357 2.2554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3985 -0.0152 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7094 0.7139 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.7094 -0.4861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7335 2.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0444 2.9427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3312 2.1720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3071 0.6722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9962 -0.0569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9721 -1.5567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2590 -2.3275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5699 -1.5984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5940 -0.0986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1261 1.4932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1063 1.1953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1953 -0.1063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1063 -1.1953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2693 -1.6034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6684 -2.2534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7474 -2.1575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0098 -1.2709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5867 2.8803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0147 -0.8802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5572 -0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3792 -1.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5485 2.0243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3412 3.3478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2879 3.8742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8304 3.8495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7597 3.2929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5095 1.9446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9234 -2.1399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2397 -3.5273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5993 -2.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6427 0.4846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9666 1.8021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2291 2.6887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 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 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 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 16 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END