0 mol 17 unq 0 iso 0 dist 6.89863 8.48453 11.074 8.80499 10.1562 5.14154 numMergedOcc 0
1 mol 17 unq 0 iso 1 dist 6.89863 8.80499 10.1562 8.48453 11.074 5.14154 numMergedOcc 0
2 mol 66 unq 0 iso 0 dist 6.90306 8.04639 6.64193 7.69019 10.2966 9.61194 numMergedOcc 0
3 mol 66 unq 0 iso 1 dist 6.90306 7.69019 10.2966 8.04639 6.64193 9.61194 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 9.27056 9.91446 6.27843 9.26343 8.71142 13.8729 numMergedOcc 0
5 mol 100 unq 0 iso 1 dist 9.27056 9.26343 8.71142 9.91446 6.27843 13.8729 numMergedOcc 0
6 mol 132 unq 0 iso 0 dist 9.51094 9.0339 10.3663 8.48641 9.16496 4.35917 numMergedOcc 0
7 mol 132 unq 0 iso 1 dist 9.51094 8.48641 9.16496 9.0339 10.3663 4.35917 numMergedOcc 0
8 mol 132 unq 1 iso 0 dist 9.51094 9.0339 10.3663 6.23573 8.10884 13.624 numMergedOcc 0
9 mol 132 unq 1 iso 1 dist 9.51094 6.23573 8.10884 9.0339 10.3663 13.624 numMergedOcc 0
10 mol 132 unq 1 iso 0 dist 9.51094 8.48641 9.16496 6.23573 8.10884 12.1165 numMergedOcc 0
11 mol 132 unq 1 iso 1 dist 9.51094 6.23573 8.10884 8.48641 9.16496 12.1165 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 8.43061 4.93035 7.862 9.75558 5.64577 6.21253 numMergedOcc 0
13 mol 141 unq 0 iso 1 dist 8.43061 9.75558 5.64577 4.93035 7.862 6.21253 numMergedOcc 0
14 mol 156 unq 0 iso 0 dist 9.36589 7.39961 10.803 7.80643 7.7394 5.76755 numMergedOcc 0
15 mol 156 unq 0 iso 1 dist 9.36589 7.80643 7.7394 7.39961 10.803 5.76755 numMergedOcc 0
16 mol 213 unq 0 iso 0 dist 8.17498 9.40939 12.2488 9.06306 17.0455 11.2306 numMergedOcc 0
17 mol 213 unq 0 iso 1 dist 8.17498 9.06306 17.0455 9.40939 12.2488 11.2306 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 5.53619 8.98617 5.40514 6.74552 4.82191 8.13129 numMergedOcc 0
19 mol 241 unq 0 iso 1 dist 5.53619 6.74552 4.82191 8.98617 5.40514 8.13129 numMergedOcc 0
20 mol 249 unq 0 iso 0 dist 9.87896 6.93507 7.61942 6.42827 5.09262 8.34718 numMergedOcc 0
21 mol 249 unq 0 iso 1 dist 9.87896 6.42827 5.09262 6.93507 7.61942 8.34718 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 6.11495 6.49599 4.53603 9.34738 7.47781 4.86771 numMergedOcc 0
23 mol 259 unq 0 iso 1 dist 6.11495 9.34738 7.47781 6.49599 4.53603 4.86771 numMergedOcc 0
24 mol 259 unq 1 iso 0 dist 6.11495 6.49599 4.53603 9.47382 11.2052 6.96053 numMergedOcc 0
25 mol 259 unq 1 iso 1 dist 6.11495 9.47382 11.2052 6.49599 4.53603 6.96053 numMergedOcc 0
26 mol 259 unq 1 iso 0 dist 6.11495 9.34738 7.47781 9.47382 11.2052 7.64658 numMergedOcc 0
27 mol 259 unq 1 iso 1 dist 6.11495 9.47382 11.2052 9.34738 7.47781 7.64658 numMergedOcc 0
28 mol 276 unq 0 iso 0 dist 8.02433 7.11272 13.0895 6.24808 5.95336 8.84158 numMergedOcc 0
29 mol 276 unq 0 iso 1 dist 8.02433 6.24808 5.95336 7.11272 13.0895 8.84158 numMergedOcc 0
