MMs01458725 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 0.5058 -1.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4643 -2.5563 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7181 -1.7328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7889 -0.2345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8886 -2.6708 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3583 -4.0739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1817 -5.3277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -4.0031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3355 -2.2751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4016 -3.3303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0208 -4.7812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8485 -2.9347 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9146 -3.9898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5338 -5.4407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3615 -3.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2293 -1.4838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6761 -1.0881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1632 -0.4286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0013 -2.8757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0107 -1.7661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4763 -2.0855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9325 -3.5145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9231 -4.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4575 -4.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3981 -3.8339 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1297 0.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4046 1.1297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1297 -0.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0269 -1.1148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2724 -2.3354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1096 -4.9396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8228 -1.1902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8252 -1.9285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7631 -4.8384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6945 -5.7453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2292 -6.6014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3731 -5.1361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2032 -3.0154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5190 -3.2776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6780 -4.7517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5399 -0.3247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3596 0.0694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8336 -0.7716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8344 -1.6669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7411 -0.8550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3103 0.4156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0073 0.4243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8282 -1.1945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2838 -1.1979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -5.7672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6499 -5.1922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 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 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 42 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 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 M END