0 mol 48 unq 0 iso 0 dist 9.04514 9.66389 5.35252 11.1779 5.03338 7.38928 7.50273 8.80801 6.39496 8.40971 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 8.92491 8.04327 5.73235 9.06225 5.22567 7.02854 17.6911 12.7637 12.6371 9.45905 numMergedOcc 0
2 mol 76 unq 1 iso 0 dist 7.41861 7.7047 5.73235 12.1652 5.22567 7.02854 17.46 12.7637 12.6371 9.45905 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 5.55798 6.05149 8.64686 8.71103 9.57704 7.41952 7.96805 11.613 10.2713 7.62846 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 6.9268 8.75242 5.79195 6.85651 5.35551 9.07294 11.5618 12.1981 11.7194 8.60913 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 6.9268 14.0828 9.2759 6.85651 5.35551 7.50126 11.5618 12.1981 11.2716 8.60913 numMergedOcc 0
6 mol 133 unq 2 iso 0 dist 8.19166 6.45333 5.79195 7.03858 5.35551 9.07294 5.74462 12.1981 11.7194 8.60913 numMergedOcc 0
7 mol 133 unq 3 iso 0 dist 8.19166 11.5586 9.2759 7.03858 5.35551 7.50126 5.74462 12.1981 11.2716 8.60913 numMergedOcc 0
8 mol 183 unq 0 iso 0 dist 7.67623 10.7145 8.29364 11.9056 6.39127 7.69421 4.79561 6.0033 6.26917 9.59741 numMergedOcc 0
9 mol 183 unq 1 iso 0 dist 7.99897 4.0252 8.29364 7.38821 6.39127 7.69421 5.24909 6.0033 6.26917 9.59741 numMergedOcc 0
10 mol 183 unq 2 iso 0 dist 7.58913 5.66126 8.29364 10.6152 6.39127 7.69421 5.7389 6.0033 6.26917 9.59741 numMergedOcc 0
11 mol 183 unq 3 iso 0 dist 6.0782 5.66126 8.97652 10.6152 9.01399 7.69421 5.7389 9.01322 6.26917 9.59741 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 4.53228 6.54316 7.58554 8.68803 5.94643 9.59937 9.67509 11.2673 10.6145 9.05655 numMergedOcc 0
13 mol 239 unq 1 iso 0 dist 8.54078 6.2497 7.58554 13.3402 5.94643 9.59937 14.2074 11.2673 10.6145 9.05655 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 8.53084 11.0749 8.58092 16.7315 13.2474 8.97411 9.91781 9.97026 7.74421 7.66806 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 5.9223 9.26732 8.58092 10.3095 13.2474 8.97411 5.62491 9.97026 7.74421 7.66806 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 7.3055 6.1113 6.57444 10.8326 5.91091 6.58277 9.3855 11.0001 4.56912 9.12381 numMergedOcc 0
17 mol 266 unq 1 iso 0 dist 7.3055 6.1113 6.57444 10.8326 5.91091 6.58277 14.0189 13.3746 8.89693 8.79148 numMergedOcc 0
18 mol 266 unq 2 iso 0 dist 7.3055 6.1113 6.57444 10.8326 5.91091 6.58277 17.5405 11.0568 14.5953 8.14167 numMergedOcc 0
19 mol 266 unq 3 iso 0 dist 7.3055 14.487 9.39714 10.8326 5.91091 8.12204 9.3855 11.0001 15.9506 9.12381 numMergedOcc 0
20 mol 266 unq 4 iso 0 dist 7.3055 14.487 9.39714 10.8326 5.91091 8.12204 14.0189 13.3746 14.4053 8.79148 numMergedOcc 0
21 mol 266 unq 5 iso 0 dist 7.3055 14.487 9.39714 10.8326 5.91091 8.12204 17.5405 11.0568 5.69904 8.14167 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 6.91029 5.64983 6.02879 10.5115 5.40861 8.26333 15.609 12.745 12.9657 7.70185 numMergedOcc 0
23 mol 273 unq 1 iso 0 dist 6.91029 5.64983 6.02879 10.5115 5.40861 8.26333 12.565 11.3323 12.6195 7.97117 numMergedOcc 0
24 mol 294 unq 0 iso 0 dist 9.4943 7.88101 9.77023 11.7157 7.87494 5.76337 11.5182 13.716 5.78097 8.49287 numMergedOcc 0
