0 mol 1 unq 0 iso 0 dist 6.93809 5.30121 9.84681 8.19503 5.06175 12.4172 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 6.47443 8.65597 9.06457 8.22631 7.93277 15.4256 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 9.03138 8.64357 7.73662 5.0723 6.72365 3.80563 numMergedOcc 0
3 mol 33 unq 1 iso 0 dist 9.03138 7.22218 9.68007 5.0723 6.72365 5.24877 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 9.35075 10.6879 9.9555 8.95658 6.42037 5.41488 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 5.55714 6.21973 9.61448 4.36329 9.86535 7.13909 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 7.71523 9.87036 6.7188 5.39664 8.4083 6.27354 numMergedOcc 0
7 mol 192 unq 0 iso 0 dist 9.62225 7.4314 7.578 8.02909 7.75405 8.77024 numMergedOcc 0
8 mol 192 unq 1 iso 0 dist 9.62225 7.4314 7.578 12.357 7.49971 13.9721 numMergedOcc 0
9 mol 192 unq 2 iso 0 dist 9.62225 9.81428 9.24926 8.02909 7.75405 10.2291 numMergedOcc 0
10 mol 192 unq 3 iso 0 dist 9.62225 9.81428 9.24926 12.357 7.49971 5.67211 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 5.66071 5.11289 5.08438 8.32665 6.65077 9.10689 numMergedOcc 0
12 mol 217 unq 0 iso 0 dist 4.92885 9.5885 8.46235 6.92631 8.99484 12.3099 numMergedOcc 0
13 mol 217 unq 1 iso 0 dist 4.92885 7.36436 5.27487 6.92631 8.99484 13.5035 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 9.94612 6.30987 9.03056 6.13765 7.03532 5.31074 numMergedOcc 0
15 mol 222 unq 0 iso 0 dist 8.51427 10.6493 5.07975 12.7015 7.99441 10.4672 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 5.88041 10.2723 8.83742 12.3812 8.565 5.2011 numMergedOcc 0
17 mol 229 unq 0 iso 0 dist 8.3932 9.61847 8.70717 5.30728 9.60329 5.7839 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 8.03092 8.65126 8.9327 4.56036 6.93465 6.78632 numMergedOcc 0
19 mol 242 unq 0 iso 0 dist 6.1076 11.575 9.14189 10.8179 8.29838 4.99882 numMergedOcc 0
20 mol 242 unq 1 iso 0 dist 6.34787 9.02175 9.14189 10.8888 8.29838 4.99882 numMergedOcc 0
21 mol 247 unq 0 iso 0 dist 5.52484 11.346 7.95874 10.2341 9.07781 6.27569 numMergedOcc 0
22 mol 247 unq 1 iso 0 dist 5.52484 11.346 7.95874 5.4939 6.84199 8.04601 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 9.44618 4.07526 8.16952 15.9452 8.30375 12.9291 numMergedOcc 0
24 mol 279 unq 1 iso 0 dist 9.44618 6.45021 9.67649 15.9452 8.30375 17.352 numMergedOcc 0
