0 mol 0 unq 0 iso 0 dist 7.31837 4.59249 7.30381 3.69299 9.38507 3.70144 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 4.38047 4.94741 5.7405 2.97898 5.27979 7.25076 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 6.66861 10.9658 9.95327 6.77823 6.76315 10.9175 numMergedOcc 0
3 mol 55 unq 1 iso 0 dist 6.66861 8.71074 7.50825 6.77823 6.76315 4.97794 numMergedOcc 0
4 mol 55 unq 2 iso 0 dist 6.72084 6.24438 9.95327 8.80267 6.76315 10.9175 numMergedOcc 0
5 mol 55 unq 3 iso 0 dist 6.72084 12.0589 7.50825 8.80267 6.76315 4.97794 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 5.84625 7.7624 7.88172 6.09663 6.41008 11.7255 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 7.11127 7.18999 8.66742 3.94069 8.4219 5.49646 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 6.37888 4.90255 8.66742 6.87448 8.4219 5.49646 numMergedOcc 0
9 mol 92 unq 2 iso 0 dist 7.11438 9.84923 8.66742 12.6706 8.4219 5.49646 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 7.4518 12.7865 8.0955 14.6061 7.83506 4.98735 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 8.4733 9.73554 6.13508 3.80816 6.21165 8.99475 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 7.6793 5.05068 6.37143 7.06015 6.90583 3.82773 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 7.6793 5.05068 6.37143 6 6.75593 9.09917 numMergedOcc 0
14 mol 141 unq 2 iso 0 dist 7.6793 5.05068 6.37143 8.90391 8.83562 12.0783 numMergedOcc 0
15 mol 141 unq 3 iso 0 dist 6.78469 8.34522 9.80549 10.5537 9.62774 4.45608 numMergedOcc 0
16 mol 141 unq 4 iso 0 dist 8.01453 7.89112 9.80549 5.51254 9.62774 4.45608 numMergedOcc 0
17 mol 175 unq 0 iso 0 dist 7.42278 8.62822 8.57607 3.47137 4.9606 7.97895 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 8.7085 7.33956 7.43301 5.00761 9.06389 3.74444 numMergedOcc 0
19 mol 237 unq 0 iso 0 dist 8.42502 6.26246 5.62039 3.78608 8.95332 6.41985 numMergedOcc 0
20 mol 249 unq 0 iso 0 dist 6.58109 5.34664 4.68783 14.8497 8.76518 10.5184 numMergedOcc 0
21 mol 253 unq 0 iso 0 dist 9.69704 17.557 9.6479 7.8581 9.82605 18.2165 numMergedOcc 0
22 mol 253 unq 1 iso 0 dist 9.69704 17.557 9.6479 8.46732 9.73723 15.9194 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 8.76332 13.6976 9.56169 9.4876 8.79261 14.2203 numMergedOcc 0
24 mol 285 unq 1 iso 0 dist 8.76332 13.6976 9.56169 11.4925 9.99125 17.6669 numMergedOcc 0
25 mol 285 unq 2 iso 0 dist 8.76332 6.52069 8.02964 9.4876 8.79261 4.31553 numMergedOcc 0
26 mol 285 unq 3 iso 0 dist 8.76332 6.52069 8.02964 11.4925 9.99125 5.02414 numMergedOcc 0
27 mol 287 unq 0 iso 0 dist 7.76945 9.43452 8.9316 9.51119 9.25759 13.9634 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 7.76945 9.43452 8.9316 9.51119 9.25759 13.9634 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 7.76945 9.43452 8.9316 9.51119 9.25759 13.9634 numMergedOcc 0
30 mol 292 unq 0 iso 0 dist 6.60049 9.93138 9.46421 3.80161 9.373 12.0037 numMergedOcc 0
