0 mol 29 unq 0 iso 0 dist 9.99467 5.97548 5.36278 8.03211 9.78134 5.3571 12.6435 5.97852 9.64034 14.8532 numMergedOcc 0
1 mol 29 unq 1 iso 0 dist 9.99467 5.97548 5.36278 8.03211 9.78134 5.3571 9.5115 11.1943 8.26334 5.09702 numMergedOcc 0
2 mol 29 unq 2 iso 0 dist 9.99467 9.88128 7.50258 8.03211 9.78134 12.1835 12.6435 5.97852 6.04161 14.8532 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 9.14072 9.90363 5.06188 12.5909 8.3491 5.75684 5.41774 4.55422 7.78899 11.0597 numMergedOcc 0
4 mol 53 unq 0 iso 0 dist 9.09831 6.76039 6.70095 6.82319 8.56916 5.86191 9.33236 6.98415 9.73556 13.0995 numMergedOcc 0
5 mol 158 unq 0 iso 0 dist 8.80952 11.2678 9.96635 6.34731 7.68074 7.76298 12.5347 5.47558 9.53944 11.4226 numMergedOcc 0
6 mol 158 unq 1 iso 0 dist 8.80952 11.2678 9.96635 15.1374 9.1854 8.17573 12.5347 5.47558 9.53944 9.10671 numMergedOcc 0
7 mol 170 unq 0 iso 0 dist 9.05865 9.56212 8.10386 10.2179 9.66676 11.6479 12.5742 5.03109 8.82169 8.75024 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 5.21088 4.65303 7.36571 3.81315 7.75405 7.56199 7.93715 6.62595 5.77035 11.6201 numMergedOcc 0
9 mol 192 unq 1 iso 0 dist 8.25609 4.65303 9.17137 3.81315 7.49971 7.56199 7.93715 12.1003 5.77035 11.6201 numMergedOcc 0
10 mol 192 unq 2 iso 0 dist 8.25609 4.65303 9.17137 9.53633 9.07427 9.186 7.93715 12.1003 5.77035 14.8237 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 9.04342 4.03375 5.61326 8.79306 8.84149 7.83764 10.3127 4.3166 7.75518 6.396 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 8.47833 11.2438 6.43519 6.10058 7.53734 6.31671 12.239 10.4922 5.63283 6.40171 numMergedOcc 0
13 mol 205 unq 1 iso 0 dist 5.47586 7.47443 6.43519 3.50446 7.53734 6.31671 8.69512 10.4922 5.63283 6.40171 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 6.96248 5.66584 7.14859 11.9352 8.43856 13.8618 9.27722 5.93557 7.19568 14.2829 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 6.96248 5.66584 7.14859 11.9352 8.43856 13.8618 9.27722 5.93557 7.19568 14.2829 numMergedOcc 0
16 mol 289 unq 0 iso 0 dist 6.96248 5.66584 7.14859 11.9352 8.43856 13.8618 9.27722 5.93557 7.19568 14.2829 numMergedOcc 0
