0 mol 28 unq 0 iso 0 dist 5.06086 6.62508 4.11841 5.98169 8.11586 11.4558 numMergedOcc 0
1 mol 79 unq 0 iso 0 dist 7.52639 7.56 6.13696 6.29801 3.40476 3.07021 numMergedOcc 0
2 mol 107 unq 0 iso 0 dist 7.06322 8.2411 8.65482 4.99934 3.35244 5.88785 numMergedOcc 0
3 mol 116 unq 0 iso 0 dist 9.38436 7.54622 5.03041 9.70317 8.39934 3.66183 numMergedOcc 0
4 mol 159 unq 0 iso 0 dist 7.85513 9.50607 3.29432 8.11352 4.31404 7.43333 numMergedOcc 0
5 mol 169 unq 0 iso 0 dist 6.47837 5.87263 3.38465 6.18165 6.05322 3.18152 numMergedOcc 0
6 mol 171 unq 0 iso 0 dist 6.07578 5.98495 3.4213 8.00826 8.3501 8.19592 numMergedOcc 0
7 mol 225 unq 0 iso 0 dist 8.65437 4.58113 6.0078 6.15671 9.66765 5.31124 numMergedOcc 0
8 mol 258 unq 0 iso 0 dist 6.26195 8.34536 3.34873 8.86773 5.7139 3.04079 numMergedOcc 0
9 mol 258 unq 1 iso 0 dist 6.26195 8.34536 3.34873 8.95095 4.05528 6.41309 numMergedOcc 0
10 mol 266 unq 0 iso 0 dist 7.57543 8.6959 5.49879 7.51951 8.28959 12.9145 numMergedOcc 0
11 mol 266 unq 1 iso 0 dist 8.55542 8.6959 9.07687 7.51951 15.2829 12.9145 numMergedOcc 0
12 mol 266 unq 2 iso 0 dist 8.93788 8.6959 13.4148 7.51951 16.0845 12.9145 numMergedOcc 0
13 mol 287 unq 0 iso 0 dist 7.64453 7.37164 8.57968 7.96707 3.39991 7.98095 numMergedOcc 0
14 mol 288 unq 0 iso 0 dist 7.64453 7.37164 8.57968 7.96707 3.39991 7.98095 numMergedOcc 0
15 mol 289 unq 0 iso 0 dist 7.64453 7.37164 8.57968 7.96707 3.39991 7.98095 numMergedOcc 0
