0 mol 9 unq 0 iso 0 dist 9.4523 6.81709 6.20124 14.5187 8.64915 11.4263 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 9.4523 6.81709 6.20124 10.6489 8.17347 10.2418 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 9.4523 6.81709 6.20124 7.17062 7.83133 10.1124 numMergedOcc 0
3 mol 17 unq 0 iso 0 dist 6.53817 9.16861 12.6863 10.8117 9.78331 16.759 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 8.18518 5.36258 6.55187 10.5195 6.41575 11.3136 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 8.23292 6.80822 4.70708 14.4951 7.45383 10.7875 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 8.23292 6.80822 4.70708 6.39668 9.01548 6.63839 numMergedOcc 0
7 mol 41 unq 0 iso 0 dist 4.68793 7.64235 6.59294 8.68242 8.51663 14.5738 numMergedOcc 0
8 mol 41 unq 1 iso 0 dist 4.68793 6.00623 5.62412 8.68242 8.51663 11.5594 numMergedOcc 0
9 mol 41 unq 2 iso 0 dist 4.68793 6.59367 5.0364 8.68242 8.51663 6.42834 numMergedOcc 0
10 mol 75 unq 0 iso 0 dist 7.16583 7.14313 10.0425 6.05353 9.81166 13.1026 numMergedOcc 0
11 mol 102 unq 0 iso 0 dist 9.0361 6.793 5.498 13.32 8.31932 13.2332 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 7.21902 6.26422 6.01663 9.37324 9.72053 6.90634 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 7.5984 8.57285 5.44503 11.4055 7.78652 13.204 numMergedOcc 0
14 mol 143 unq 1 iso 0 dist 7.5984 8.57285 5.44503 9.54731 8.91301 13.8861 numMergedOcc 0
15 mol 171 unq 0 iso 0 dist 6.01711 7.13078 5.38746 6.4423 9.61462 12.4821 numMergedOcc 0
16 mol 175 unq 0 iso 0 dist 9.45659 7.77669 10.6973 14.0022 9.77896 18.665 numMergedOcc 0
17 mol 219 unq 0 iso 0 dist 8.09769 9.38761 4.74167 6.66401 7.59632 11.4406 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 7.27481 7.46845 7.61682 13.0565 9.07471 16.4961 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 6.54753 6.59786 4.89568 7.10817 8.83865 8.68913 numMergedOcc 0
20 mol 273 unq 1 iso 0 dist 6.54753 7.96519 11.5447 7.10817 8.83865 10.8919 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 7.30618 8.40198 4.62998 8.32567 8.91712 5.59555 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 7.30618 9.95761 12.5126 8.32567 8.91712 16.1426 numMergedOcc 0
23 mol 287 unq 2 iso 0 dist 9.22306 9.11967 4.62998 7.04567 8.91712 5.59555 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 7.30618 8.40198 4.62998 8.32567 8.91712 5.59555 numMergedOcc 0
25 mol 288 unq 1 iso 0 dist 7.30618 9.95761 12.5126 8.32567 8.91712 16.1426 numMergedOcc 0
26 mol 288 unq 2 iso 0 dist 9.22306 9.11967 4.62998 7.04567 8.91712 5.59555 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 7.30618 8.40198 4.62998 8.32567 8.91712 5.59555 numMergedOcc 0
28 mol 289 unq 1 iso 0 dist 7.30618 9.95761 12.5126 8.32567 8.91712 16.1426 numMergedOcc 0
29 mol 289 unq 2 iso 0 dist 9.22306 9.11967 4.62998 7.04567 8.91712 5.59555 numMergedOcc 0
