0 0 2 This is a remark line molecule.res MOL 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 1.523 111.21 .0 .00000 4 O2 o M 3 2 1 1.540 111.208 -180.000 -0.784927 5 C11 c M 4 3 2 1.256 119.328 -172.388 0.816881 6 O3 o E 5 4 3 1.265 126.929 -4.131 -0.784927 7 C5 cd M 5 4 3 1.544 117.672 177.681 -0.292842 8 C4 cc M 7 5 4 1.370 115.933 164.354 -0.122090 9 H3 h4 E 8 7 5 1.084 117.588 3.160 0.180907 10 N1 na M 8 7 5 1.365 126.620 -176.641 -0.194197 11 C3 c3 3 10 8 7 1.476 120.044 -178.507 0.282454 12 C9 c3 3 11 10 8 1.528 112.822 94.948 -0.225304 13 H5 hc E 12 11 10 1.093 110.773 61.725 0.053348 14 H6 hc E 12 11 10 1.094 109.713 -178.752 0.053348 15 H7 hc E 12 11 10 1.095 111.103 -59.204 0.053348 16 H1 h1 E 11 10 8 1.090 107.662 -142.781 -0.018814 17 H2 h1 E 11 10 8 1.092 106.666 -26.835 -0.018814 18 C1 ca M 10 8 7 1.388 119.094 -0.448 0.581997 19 N2 nb M 18 10 8 1.343 117.456 179.183 -0.628300 20 C8 ca M 19 18 10 1.336 118.528 -179.502 0.609440 21 C12 c3 3 20 19 18 1.508 116.530 179.393 -0.532895 22 H9 hc E 21 20 19 1.096 110.340 -62.697 0.137979 23 H10 hc E 21 20 19 1.095 110.442 55.400 0.137979 24 H11 hc E 21 20 19 1.091 111.635 176.573 0.137979 25 C10 ca M 20 19 18 1.409 122.125 -0.332 -0.551241 26 H8 ha E 25 20 19 1.084 120.029 -179.839 0.184222 27 C7 ca M 25 20 19 1.385 118.788 0.033 0.152333 28 H4 ha E 27 25 20 1.085 121.855 -179.812 0.125595 29 C2 ca M 27 25 20 1.401 120.339 0.218 -0.451748 30 C6 c M 29 27 25 1.487 120.766 179.861 0.692736 31 O1 o M 30 29 27 1.243 119.406 2.979 -0.594447 LOOP C6 C5 C2 C1 IMPROPER C5 O2 C11 O3 C6 C11 C5 C4 C5 H3 C4 N1 C3 C1 N1 C4 C2 N1 C1 N2 C12 C10 C8 N2 C8 C7 C10 H8 C10 C2 C7 H4 C6 C1 C2 C7 C2 C5 C6 O1 DONE STOP