0 mol 45 unq 0 iso 0 dist 6.1517 9.60864 5.45932 6.74214 7.55443 11.1846 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.06519 8.16033 7.12927 3.42062 7.32699 9.42099 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 7.54027 8.16033 5.77634 3.42062 6.45933 9.42099 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 8.12546 9.05101 10.8019 3.47529 7.05964 11.4443 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 4.22514 6.54052 5.01159 11.8083 9.63616 5.27979 numMergedOcc 0
5 mol 83 unq 0 iso 0 dist 7.16429 9.52901 5.97632 12.8944 9.98298 9.51787 numMergedOcc 0
6 mol 83 unq 1 iso 0 dist 7.16429 9.52901 5.97632 10.4765 7.55036 9.99996 numMergedOcc 0
7 mol 83 unq 2 iso 0 dist 7.16429 9.52901 5.97632 6.73998 8.32248 13.5262 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 7.71664 8.19294 5.6007 5.17954 9.04366 8.00013 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 5.50402 6.41084 6.69013 9.50148 9.50762 10.6112 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 5.50402 6.41084 6.69013 10.2696 7.57472 4.92382 numMergedOcc 0
11 mol 147 unq 0 iso 0 dist 7.2409 9.70579 5.93581 3.35238 8.84926 12.1461 numMergedOcc 0
12 mol 264 unq 0 iso 0 dist 9.03169 8.68638 15.0662 3.9472 9.26331 11.5459 numMergedOcc 0
13 mol 278 unq 0 iso 0 dist 7.99979 8.04121 10.7651 4.32613 5.35362 9.9444 numMergedOcc 0
14 mol 278 unq 1 iso 0 dist 7.99979 8.04121 10.7651 7.34756 8.22364 14.5823 numMergedOcc 0
15 mol 278 unq 2 iso 0 dist 8.0742 9.74549 13.1167 3.64811 5.35362 11.8664 numMergedOcc 0
16 mol 278 unq 3 iso 0 dist 8.0742 9.74549 13.1167 6.31745 8.22364 15.8656 numMergedOcc 0
17 mol 278 unq 4 iso 0 dist 8.0742 8.91606 7.41736 3.64811 5.35362 8.1769 numMergedOcc 0
18 mol 278 unq 5 iso 0 dist 8.0742 8.91606 7.41736 6.31745 8.22364 7.1656 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 5.15432 6.35591 8.0692 3.75969 5.76793 9.78784 numMergedOcc 0
20 mol 279 unq 1 iso 0 dist 5.15432 6.35591 8.0692 11.1754 7.72276 15.4981 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 8.85872 8.58448 10.3593 3.76412 9.2144 11.062 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 8.85872 8.58448 10.3593 5.39384 8.36585 13.1556 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 8.85872 8.58448 10.3593 3.76412 9.2144 11.062 numMergedOcc 0
24 mol 288 unq 1 iso 0 dist 8.85872 8.58448 10.3593 5.39384 8.36585 13.1556 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 8.85872 8.58448 10.3593 3.76412 9.2144 11.062 numMergedOcc 0
26 mol 289 unq 1 iso 0 dist 8.85872 8.58448 10.3593 5.39384 8.36585 13.1556 numMergedOcc 0
