0 mol 26 unq 0 iso 0 dist 8.8533 10.1933 5.69955 13.0107 6.81213 7.51406 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 6.87744 10.4881 5.69955 9.41865 6.81213 7.51406 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 6.40398 10.9094 8.7817 8.69758 5.77009 8.21595 numMergedOcc 0
3 mol 30 unq 1 iso 0 dist 6.40398 11.8694 7.55415 8.69758 5.77009 9.60744 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 9.17687 14.4151 9.93832 16.8547 8.33667 9.17086 numMergedOcc 0
5 mol 70 unq 0 iso 0 dist 9.33262 9.66495 6.54023 9.60641 6.69775 7.63663 numMergedOcc 0
6 mol 70 unq 1 iso 0 dist 4.67358 5.33532 6.54023 7.68652 6.69775 7.63663 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 9.17137 12.602 5.88354 17.2049 10.8678 7.00285 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 9.17137 12.602 5.88354 18.912 13.5865 8.02354 numMergedOcc 0
9 mol 98 unq 2 iso 0 dist 9.17137 10.4811 8.8368 13.044 9.70366 9.00692 numMergedOcc 0
10 mol 98 unq 3 iso 0 dist 9.17137 10.4811 8.8368 10.0359 7.63357 6.26542 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 9.95454 6.1522 5.10618 13.1953 6.15895 7.13441 numMergedOcc 0
12 mol 195 unq 0 iso 0 dist 8.22643 13.577 7.62942 17.886 9.80071 8.3705 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 9.88251 13.9684 5.60393 13.2201 6.37333 6.15806 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 8.84133 12.0174 5.45036 14.0757 6.71715 6.21273 numMergedOcc 0
15 mol 220 unq 1 iso 0 dist 8.81001 9.89208 5.45036 12.0636 6.71715 6.21273 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 5.5826 11.1632 6.66971 11.3851 6.85179 5.67917 numMergedOcc 0
17 mol 238 unq 1 iso 0 dist 5.5826 11.0996 6.4398 11.3851 6.85179 8.96639 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 8.74485 6.80725 8.67805 5.85061 5.71442 8.7017 numMergedOcc 0
19 mol 239 unq 1 iso 0 dist 8.74485 6.80725 8.67805 12.1141 8.88857 9.51583 numMergedOcc 0
20 mol 240 unq 0 iso 0 dist 5.46783 14.5429 9.47583 20.9186 17.2138 9.68888 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 8.43941 9.88911 9.53063 14.3247 7.43645 8.9706 numMergedOcc 0
22 mol 278 unq 0 iso 0 dist 9.03362 12.6489 7.67245 16.246 12.325 7.58272 numMergedOcc 0
