MMs01792074 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 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 1.2934 -0.7597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2822 -2.2597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6092 1.4805 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6092 2.6805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3158 2.2402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3271 3.7402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9138 2.2208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9228 3.4208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2072 1.4611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5118 2.2014 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5511 2.8014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5231 3.7013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2297 4.4610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2409 5.9610 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9475 6.7207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8052 1.4417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0874 -0.8180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.0777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6854 -0.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9900 -0.0972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0012 1.4028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7078 2.1625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4032 1.4222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1098 2.1819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1211 3.6819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6078 1.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0347 0.6078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6078 -1.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2542 -1.3597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0822 -2.2507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2732 -3.4596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4821 -2.2686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.1501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7813 0.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7032 3.4841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9419 4.8258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8108 3.3365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0495 4.6782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5553 7.7554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9128 7.3284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3397 5.6859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7503 -0.6505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6764 -2.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0247 -0.7049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0449 1.9950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7168 3.3624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0112 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0235 2.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 51 1 0 0 0 0 9 10 1 0 0 0 0 9 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 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 51 52 1 0 0 0 0 M END