0 mol 28 unq 0 iso 0 dist 6.62508 5.51879 6.87842 5.98169 11.4558 8.94643 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 9.77719 9.5295 6.87842 10.0347 11.4558 8.94643 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 8.14006 4.29159 6.27293 5.23167 5.87787 7.01397 numMergedOcc 0
3 mol 159 unq 0 iso 0 dist 9.50607 4.67118 9.45909 8.11352 7.43333 8.61788 numMergedOcc 0
4 mol 168 unq 0 iso 0 dist 8.65328 7.36888 8.18217 9.57924 6.06538 5.64732 numMergedOcc 0
5 mol 168 unq 1 iso 0 dist 8.65328 7.36888 8.18217 8.47439 10.919 5.52214 numMergedOcc 0
6 mol 168 unq 2 iso 0 dist 8.65328 7.36888 8.18217 12.6902 13.0096 5.80055 numMergedOcc 0
7 mol 168 unq 3 iso 0 dist 8.65328 7.36888 8.18217 13.2373 14.104 7.44481 numMergedOcc 0
8 mol 169 unq 0 iso 0 dist 5.87263 12.2667 7.06772 6.18165 3.18152 6.27378 numMergedOcc 0
9 mol 198 unq 0 iso 0 dist 8.18482 7.58767 9.40433 9.55667 3.70259 7.95437 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 6.3407 16.0229 9.79826 21.3014 15.4119 9.21286 numMergedOcc 0
11 mol 225 unq 0 iso 0 dist 4.58113 5.97855 8.69052 6.15671 5.31124 6.35772 numMergedOcc 0
12 mol 266 unq 0 iso 0 dist 6.61768 8.13583 8.9221 7.36685 3.14784 6.39822 numMergedOcc 0
13 mol 266 unq 1 iso 0 dist 6.61768 8.13583 8.9221 9.03099 5.95721 5.36518 numMergedOcc 0
14 mol 266 unq 2 iso 0 dist 6.61768 4.80695 9.51145 6.9943 3.68488 9.90506 numMergedOcc 0
15 mol 266 unq 3 iso 0 dist 6.61768 4.80695 9.51145 7.36685 3.14784 8.61077 numMergedOcc 0
16 mol 266 unq 4 iso 0 dist 6.61768 4.80695 9.51145 9.03099 5.95721 9.11585 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 8.20902 4.00063 6.42951 7.34927 10.5214 9.07744 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 7.98589 11.2565 6.42951 10.0835 10.5214 9.07744 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 7.37164 6.18486 5.83857 10.8476 5.96434 5.44942 numMergedOcc 0
20 mol 287 unq 1 iso 0 dist 7.37164 9.62966 5.32839 10.8476 5.96434 7.82157 numMergedOcc 0
21 mol 287 unq 2 iso 0 dist 7.37164 9.62966 5.32839 10.7924 7.33038 8.39976 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 7.37164 6.18486 5.83857 10.8476 5.96434 5.44942 numMergedOcc 0
23 mol 288 unq 1 iso 0 dist 7.37164 9.62966 5.32839 10.8476 5.96434 7.82157 numMergedOcc 0
24 mol 288 unq 2 iso 0 dist 7.37164 9.62966 5.32839 10.7924 7.33038 8.39976 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 7.37164 6.18486 5.83857 10.8476 5.96434 5.44942 numMergedOcc 0
26 mol 289 unq 1 iso 0 dist 7.37164 9.62966 5.32839 10.8476 5.96434 7.82157 numMergedOcc 0
27 mol 289 unq 2 iso 0 dist 7.37164 9.62966 5.32839 10.7924 7.33038 8.39976 numMergedOcc 0
