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PM3 PRECISE XYZ C -0.986 1 2.761 1 -0.087 1 C -0.541 1 1.304 1 0.076 1 C -0.733 1 0.849 1 1.541 1 C -0.288 1 -0.612 1 1.711 1 C 1.196 1 -0.74 1 1.333 1 C 1.418 1 -0.309 1 -0.134 1 C 2.899 1 -0.438 1 -0.505 1 C 0.952 1 1.156 1 -0.298 1 C 0.557 1 -1.21 1 -1.052 1 C -0.936 1 -1.087 1 -0.681 1 N -1.73 1 -1.955 1 -1.55 1 C -1.128 1 -1.512 1 0.789 1 C -1.377 1 0.384 1 -0.844 1 H -0.403 1 3.427 1 0.559 1 H -2.043 1 2.883 1 0.174 1 H -0.856 1 3.1 1 -1.121 1 H -1.786 1 0.95 1 1.835 1 H -0.155 1 1.491 1 2.217 1 H -0.43 1 -0.92 1 2.753 1 H 1.802 1 -0.12 1 2.007 1 H 1.526 1 -1.776 1 1.479 1 H 3.245 1 -1.472 1 -0.394 1 H 3.523 1 0.194 1 0.137 1 H 3.074 1 -0.137 1 -1.543 1 H 1.112 1 1.485 1 -1.334 1 H 1.562 1 1.815 1 0.335 1 H 0.885 1 -2.255 1 -0.961 1 H 0.712 1 -0.926 1 -2.102 1 H -1.628 1 -1.66 1 -2.521 1 H -2.72 1 -1.856 1 -1.327 1 H -0.831 1 -2.56 1 0.928 1 H -2.186 1 -1.444 1 1.075 1 H -1.262 1 0.7 1 -1.89 1 H -2.444 1 0.488 1 -0.603 1 Bond info. 1 2 1 1 14 1 1 15 1 1 16 1 2 3 1 2 8 1 2 13 1 3 4 1 3 17 1 3 18 1 4 5 1 4 12 1 4 19 1 5 6 1 5 20 1 5 21 1 6 7 1 6 8 1 6 9 1 7 22 1 7 23 1 7 24 1 8 25 1 8 26 1 9 10 1 9 27 1 9 28 1 10 11 1 10 12 1 10 13 1 11 29 1 11 30 1 12 31 1 12 32 1 13 33 1 13 34 1