MMs01236691 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 59 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 1.3018 0.7452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0097 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8999 0.7355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9055 2.2355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3474 -1.5117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8134 -1.8290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5682 -0.5327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5687 0.5857 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0606 -0.3815 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6758 0.9865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7986 2.2033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1681 1.1378 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3273 1.4484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7833 2.5058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9062 3.7226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5214 5.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6442 6.3075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1519 6.1562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5367 4.7882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4138 3.5714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0453 -0.0790 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5765 -1.5039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1482 -1.9621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7867 -2.3900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9380 -3.8824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3060 -4.4976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5228 -3.6204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3716 -2.1281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0035 -1.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5453 -0.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4315 1.1257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4184 -3.2016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0234 -4.5741 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2289 -2.5112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5961 1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0415 -0.5961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5961 -1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5339 1.6673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0766 1.6615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7623 -1.3549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7757 1.8311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6201 3.3659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7153 5.2117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1364 7.4019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4501 7.1296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3428 4.6672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1677 3.0242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9645 -4.5841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4270 -5.6915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6172 -4.1126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3450 -1.4263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4293 -1.6165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3342 -3.3109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0286 -3.4060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 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 36 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 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 49 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 34 35 3 0 0 0 0 36 54 1 0 0 0 0 36 55 1 0 0 0 0 36 56 1 0 0 0 0 M END