0 0 2 This is a remark line molecule.res OAS 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 C1 CT M 3 2 1 1.540 111.208 180.000 -0.20139 5 H1 HC E 4 3 2 1.091 142.857 0.000 0.04139 6 H2 HC E 4 3 2 1.092 93.726 126.081 0.04139 7 H3 HC E 4 3 2 1.092 93.726 -126.081 0.04139 8 C2 CT M 4 3 2 1.528 31.401 -0.000 0.15685 9 H4 HC E 8 4 3 1.094 109.485 -122.092 -0.03145 10 H5 HC E 8 4 3 1.094 109.485 122.092 -0.03145 11 C3 CT M 8 4 3 1.530 113.257 0.000 0.01168 12 H6 HC E 11 8 4 1.094 109.174 57.735 -0.01106 13 H7 HC E 11 8 4 1.095 109.195 -57.696 -0.01106 14 C4 CT M 11 8 4 1.530 113.650 -180.000 0.04599 15 H8 HC E 14 11 8 1.094 109.230 57.767 -0.02614 16 H9 HC E 14 11 8 1.094 109.230 -57.767 -0.02614 17 C5 CT M 14 11 8 1.531 113.619 180.000 0.04599 18 H10 HC E 17 14 11 1.094 109.236 57.771 -0.02614 19 H11 HC E 17 14 11 1.094 109.236 -57.771 -0.02614 20 C6 CT M 17 14 11 1.530 113.619 -180.000 0.01168 21 H12 HC E 20 17 14 1.094 109.277 57.791 -0.01106 22 H13 HC E 20 17 14 1.094 109.277 -57.791 -0.01106 23 C7 CT M 20 17 14 1.530 113.650 180.000 0.15685 24 H14 HC E 23 20 17 1.094 109.174 57.735 -0.03145 25 H15 HC E 23 20 17 1.094 109.174 -57.735 -0.03145 26 C8 CT M 23 20 17 1.528 113.257 -180.000 -0.20139 27 H16 HC E 26 23 20 1.091 111.456 180.000 0.04139 28 H17 HC E 26 23 20 1.092 111.203 59.886 0.04139 29 H18 HC E 26 23 20 1.092 111.203 -59.886 0.04139 LOOP IMPROPER DONE STOP