0 0 2 This is a remark line molecule.res RU5 INT 0 CORRECT OMIT DU BEG 0.0000 1 DUMM DU M 0 -1 -2 0.000 .0 .0 .00000 2 DUMM DU M 1 0 -1 1.449 .0 .0 .00000 3 DUMM DU M 2 1 0 1.522 111.1 .0 .00000 4 O2* o M 3 2 1 1.540 111.208 180.000 -0.77905 5 C2* c3 M 4 3 2 1.411 103.691 38.901 0.41834 6 H2*1 h1 E 5 4 3 1.090 111.842 -152.812 -0.04072 7 C1* c3 M 5 4 3 1.519 111.070 -26.210 0.16271 8 H1* h2 E 7 5 4 1.090 112.529 -52.407 0.11766 9 O4* os M 7 5 4 1.408 106.585 71.222 -0.41305 10 C4* c3 M 9 7 5 1.415 106.342 31.007 0.08148 11 C5* c3 3 10 9 7 1.527 112.459 119.946 0.12325 12 O5* oh S 11 10 9 1.440 111.229 -115.191 -0.61535 13 H5T ho E 12 11 10 0.960 118.995 -177.494 0.40683 14 H5*1 h1 E 11 10 9 1.089 110.556 6.665 0.03074 15 H5*2 h1 E 11 10 9 1.090 106.575 125.558 0.05854 16 H4* h1 E 10 9 7 1.090 107.942 -119.943 0.08341 17 C3* c3 M 10 9 7 1.529 107.062 -3.055 -0.01544 18 H3* h1 E 17 10 9 1.090 111.404 -145.784 0.09251 19 O29 os M 17 10 9 1.504 110.683 91.099 -0.33384 20 C6 cc M 19 17 10 1.407 112.143 -66.717 0.33712 21 N1 n M 20 19 17 1.370 120.869 -1.767 -0.39027 22 C2 c M 21 20 19 1.381 122.021 178.351 0.81275 23 O2 o E 22 21 20 1.229 122.063 -179.790 -0.66683 24 N3 n M 22 21 20 1.385 116.140 1.063 -0.60139 25 H3 hn E 24 22 21 1.010 117.102 179.909 0.33319 26 C4 c M 24 22 21 1.385 125.679 0.570 0.73445 27 O4 o E 26 24 22 1.229 120.624 179.563 -0.67918 28 C5 cd M 26 24 22 1.445 114.065 -1.307 -0.42839 29 H5 ha E 28 26 24 1.079 119.271 -178.901 0.17053 LOOP C3* C2* N1 C1* C5 C6 IMPROPER C5 N1 C6 O29 C2 C1* N1 C6 N1 N3 C2 O2 C2 C4 N3 H3 C5 N3 C4 O4 C4 C6 C5 H5 DONE STOP