0 mol 34 unq 0 iso 0 dist 9.12062 5.39587 13.3334 10.0272 19.0823 7.01952 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 9.12062 5.39587 13.3334 6.65242 15.7464 4.58552 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 7.68259 7.07124 10.6754 12.3961 17.5733 9.47401 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 9.073 6.09085 6.4113 10.6564 10.7153 5.7369 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 9.60134 5.91019 10.0714 13.2897 15.4587 8.46627 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 9.60134 5.91019 10.0714 14.1134 12.7234 9.22208 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 7.98824 9.28726 6.69911 10.8273 14.5265 9.59729 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 9.42329 9.28726 3.94216 10.8273 13.12 9.59729 numMergedOcc 0
8 mol 103 unq 0 iso 0 dist 9.71805 5.62245 6.28696 6.18487 11.6507 5.42044 numMergedOcc 0
9 mol 103 unq 1 iso 0 dist 4.9418 5.62245 3.86836 6.18487 4.49975 5.42044 numMergedOcc 0
10 mol 103 unq 2 iso 0 dist 5.7953 5.62245 8.52805 6.18487 10.9982 5.42044 numMergedOcc 0
11 mol 122 unq 0 iso 0 dist 8.3907 6.91978 3.65582 6.16219 11.0369 9.47049 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 8.49649 7.96353 11.0328 6.67639 14.5055 8.14226 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 8.49649 7.96353 11.0328 4.4987 10.2498 5.78982 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.51189 9.00537 12.4735 12.9635 19.8748 8.5672 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 6.22466 8.9388 3.6848 4.68208 6.26168 8.5672 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 5.7709 6.27266 3.7157 4.7754 8.60546 8.22795 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 9.19343 7.59666 4.98276 5.10199 8.61912 9.26214 numMergedOcc 0
18 mol 204 unq 1 iso 0 dist 9.19343 6.51936 3.72636 5.10199 8.61912 5.00369 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 8.36772 6.0751 6.41724 6.49444 14.0278 9.01338 numMergedOcc 0
20 mol 233 unq 1 iso 0 dist 8.83541 6.0751 10.8172 6.49444 12.9424 9.01338 numMergedOcc 0
21 mol 233 unq 2 iso 0 dist 7.55878 6.0751 3.98113 6.49444 8.7831 9.01338 numMergedOcc 0
