18 WFHMO XYZ 2011.11.29 C 1.23510 1.40500 0.00000 C 2.44800 0.69420 0.00000 C 2.44330 -0.71130 0.00000 C 1.22540 -1.41360 0.00000 C -1.23510 -1.40500 0.00000 C -2.44800 -0.69420 0.00000 C -2.44330 0.71130 0.00000 C -1.22540 1.41360 0.00000 C 0.00250 0.71340 0.00000 C -0.00250 -0.71340 0.00000 H 1.26180 2.42840 0.00000 H 3.33500 1.20180 0.00000 H 3.32670 -1.22510 0.00000 H 1.24490 -2.43710 0.00000 H -1.26180 -2.42840 0.00000 H -3.33500 -1.20200 0.00000 H -3.32670 1.22510 0.00000 H -1.24490 2.43710 0.00000 10 5 5 5 NAPHTHALIN 0 0 1 6 1.23510 1.40500 0.00000 1 2 6 2.44800 0.69420 0.00000 1 3 6 2.44330 -0.71130 0.00000 1 4 6 1.22540 -1.41360 0.00000 1 5 6 -1.23510 -1.40500 0.00000 1 6 6 -2.44800 -0.69420 0.00000 1 7 6 -2.44330 0.71130 0.00000 1 8 6 -1.22540 1.41360 0.00000 1 9 6 0.00250 0.71340 0.00000 1 10 6 -0.00250 -0.71340 0.00000 1 WFHMO 1 2.30278 2 0.3006 0.2307 0.2307 0.3006 0.3006 0.2307 0.2307 0.3006 0.4614 0.4614 WFHMO 2 1.61803 2 -0.2629 -0.4253 -0.4253 -0.2629 0.2629 0.4253 0.4253 0.2629 0.0000 0.0000 WFHMO 3 1.30278 2 0.3996 0.1735 -0.1735 -0.3996 -0.3996 -0.1735 0.1735 0.3996 0.3470 -0.3470 WFHMO 4 1.00000 2 0.0000 -0.4082 -0.4082 0.0000 0.0000 -0.4082 -0.4082 0.0000 0.4082 0.4082 WFHMO 5 0.61803 2 -0.4253 -0.2629 0.2629 0.4253 -0.4253 -0.2629 0.2629 0.4253 0.0000 0.0000 WFHMO 6 -0.61803 0 0.4253 -0.2629 -0.2629 0.4253 -0.4253 0.2629 0.2629 -0.4253 0.0000 0.0000 WFHMO 7 -1.00000 0 0.0000 -0.4082 0.4082 0.0000 0.0000 0.4082 -0.4082 0.0000 0.4082 -0.4082 WFHMO 8 -1.30278 0 0.3996 -0.1735 -0.1735 0.3996 0.3996 -0.1735 -0.1735 0.3996 -0.3470 -0.3470 WFHMO 9 -1.61803 0 -0.2629 0.4253 -0.4253 0.2629 -0.2629 0.4253 -0.4253 0.2629 0.0000 0.0000 WFHMO 10 -2.30278 0 -0.3006 0.2307 -0.2307 0.3006 0.3006 -0.2307 0.2307 -0.3006 0.4614 -0.4614