MMs01511217 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 0.7228 -1.3143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -2.5975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2225 -1.3455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9453 -2.6599 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5453 -1.6207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 -2.6911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1678 -4.0054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2219 -1.4079 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7215 -1.4391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5778 -2.6707 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0137 -2.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0449 -0.7372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6283 -0.2442 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3592 -0.0144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6112 -2.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2969 -3.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9568 -0.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2399 -0.8453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5543 -0.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8374 -0.8993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8062 -2.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4919 -3.1218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2087 -2.3449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1685 -3.9430 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8913 -5.2574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1145 -6.5406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 -5.2886 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0515 0.5783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5783 1.0515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0515 -0.5783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4772 -1.3143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0805 -1.9760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6755 -3.6240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9725 -3.2190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0387 -0.1597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3584 -0.9586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6436 -0.3564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6072 0.9207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1495 0.8886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9981 -3.4269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7971 -2.1072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5066 -3.9168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0489 -3.9489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7470 0.8346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2047 0.8667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5792 1.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8889 -0.3210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8328 -3.0204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4670 -4.3215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1573 -2.9232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9688 -3.9181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9693 -6.3401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7017 -4.7753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6424 -0.7913 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 55 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 16 55 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 55 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 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END