0 mol 4 unq 0 iso 0 dist 8.67981 7.97369 6.66589 9.6245 7.88748 4.90612 14.676 6.21697 9.80478 10.4152 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 8.34804 16.4344 8.64208 3.77705 6.44825 13.625 16.5954 8.8254 6.99398 14.1148 numMergedOcc 0
2 mol 168 unq 0 iso 0 dist 9.60268 6.51864 8.8573 5.4035 7.337 4.16504 13.3612 6.11195 9.35182 9.08906 numMergedOcc 0
3 mol 168 unq 1 iso 0 dist 8.79954 5.14137 8.8573 6.46155 7.337 4.16504 11.9617 6.11195 9.35182 9.08906 numMergedOcc 0
4 mol 219 unq 0 iso 0 dist 7.26376 5.0241 8.09769 8.72864 8.3704 11.3569 8.55971 10.4254 9.68515 16.0806 numMergedOcc 0
5 mol 219 unq 1 iso 0 dist 7.26376 5.0241 8.09769 8.72864 8.3704 11.3569 11.2519 10.676 6.75833 16.5298 numMergedOcc 0
6 mol 220 unq 0 iso 0 dist 8.55805 15.5892 7.30244 5.06821 8.63649 14.9028 10.9802 6.99846 9.58343 13.5602 numMergedOcc 0
7 mol 258 unq 0 iso 0 dist 9.17911 17.1229 8.81059 11.5766 9.6327 13.987 14.4126 7.64421 7.9357 16.844 numMergedOcc 0
8 mol 258 unq 1 iso 0 dist 9.17911 15.539 9.12006 11.5766 9.6327 15.8856 22.9841 16.5108 9.47519 24.7581 numMergedOcc 0
9 mol 258 unq 2 iso 0 dist 9.17911 15.539 9.12006 11.5766 9.6327 15.8856 14.4126 7.64421 5.79537 16.844 numMergedOcc 0
10 mol 258 unq 3 iso 0 dist 9.52903 7.52881 8.81059 11.7204 9.6327 13.987 12.3615 7.64421 7.9357 16.844 numMergedOcc 0
11 mol 258 unq 4 iso 0 dist 9.52903 12.3042 9.12006 11.7204 9.6327 15.8856 18.0375 16.5108 9.47519 24.7581 numMergedOcc 0
12 mol 258 unq 5 iso 0 dist 9.52903 12.3042 9.12006 11.7204 9.6327 15.8856 12.3615 7.64421 5.79537 16.844 numMergedOcc 0
13 mol 272 unq 0 iso 0 dist 7.38085 5.26991 8.82094 3.7218 5.38409 5.12237 11.6897 11.3373 9.80332 8.45524 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 7.47179 11.3154 7.13655 9.23896 6.06665 4.79186 10.6184 5.69849 8.98486 10.6454 numMergedOcc 0
15 mol 287 unq 1 iso 0 dist 7.47179 11.3154 7.13655 9.23896 6.06665 4.79186 13.9075 6.44062 8.70152 9.38541 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 7.47179 11.3154 7.13655 9.23896 6.06665 4.79186 10.6184 5.69849 8.98486 10.6454 numMergedOcc 0
17 mol 288 unq 1 iso 0 dist 7.47179 11.3154 7.13655 9.23896 6.06665 4.79186 13.9075 6.44062 8.70152 9.38541 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 7.47179 11.3154 7.13655 9.23896 6.06665 4.79186 10.6184 5.69849 8.98486 10.6454 numMergedOcc 0
19 mol 289 unq 1 iso 0 dist 7.47179 11.3154 7.13655 9.23896 6.06665 4.79186 13.9075 6.44062 8.70152 9.38541 numMergedOcc 0
