0 mol 0 unq 0 iso 0 dist 9.19007 6.91778 14.0232 4.99728 6.78251 9.14271 7.65806 9.64573 9.15528 9.99338 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.19007 6.91778 14.0232 4.99728 6.78251 9.14271 12.8912 7.29879 15.8251 8.13129 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 9.19007 6.91778 14.0232 4.99728 6.78251 9.14271 13.1231 11.9599 12.6486 9.07223 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 9.56794 6.91778 10.1804 4.99728 8.69282 9.14271 7.65806 6.05328 9.15528 9.99338 numMergedOcc 0
4 mol 0 unq 4 iso 0 dist 9.56794 6.91778 10.1804 4.99728 8.69282 9.14271 12.8912 10.5439 15.8251 8.13129 numMergedOcc 0
5 mol 0 unq 5 iso 0 dist 9.56794 6.91778 10.1804 4.99728 8.69282 9.14271 13.1231 10.4442 12.6486 9.07223 numMergedOcc 0
6 mol 7 unq 0 iso 0 dist 5.72491 8.72114 10.1959 4.87279 7.12105 6.04832 11.0773 14.6803 8.43473 7.5706 numMergedOcc 0
7 mol 7 unq 1 iso 0 dist 5.72491 8.72114 10.1959 4.87279 7.12105 6.04832 10.5461 10.2446 5.03847 6.28925 numMergedOcc 0
8 mol 7 unq 2 iso 0 dist 5.72491 8.72114 10.1959 4.87279 7.12105 6.04832 7.10621 5.44992 13.8829 8.70159 numMergedOcc 0
9 mol 9 unq 0 iso 0 dist 7.05346 7.32257 8.88528 5.72062 11.618 7.2707 11.938 18.2946 11.8617 7.47838 numMergedOcc 0
10 mol 9 unq 1 iso 0 dist 7.9944 6.55811 4.58685 7.6565 11.5421 7.2707 10.069 14.6233 11.8617 7.47838 numMergedOcc 0
11 mol 9 unq 2 iso 0 dist 7.9944 7.36018 5.83039 7.6565 11.5421 8.99816 10.069 14.6233 9.55673 7.47838 numMergedOcc 0
12 mol 9 unq 3 iso 0 dist 7.9944 8.48677 9.06304 7.6565 11.5421 5.96667 10.069 14.6233 6.96891 7.47838 numMergedOcc 0
13 mol 9 unq 4 iso 0 dist 7.032 8.64915 4.58685 12.3746 11.5421 7.2707 13.6105 14.6233 11.8617 7.47838 numMergedOcc 0
14 mol 9 unq 5 iso 0 dist 7.032 8.17347 5.83039 12.3746 11.5421 8.99816 13.6105 14.6233 9.55673 7.47838 numMergedOcc 0
15 mol 85 unq 0 iso 0 dist 7.33422 7.54568 6.85215 11.3372 14.7935 8.60839 7.66905 10.121 4.65335 7.07868 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 6.76699 6.16242 9.34112 5.47259 6.85886 6.49688 13.268 8.28698 12.538 9.64695 numMergedOcc 0
17 mol 133 unq 1 iso 0 dist 6.76699 6.16242 9.34112 5.47259 6.85886 6.49688 6.29155 5.74088 4.54648 4.51266 numMergedOcc 0
18 mol 170 unq 0 iso 0 dist 8.15099 6.35982 7.29587 9.77705 6.79696 8.20406 12.8281 5.95519 9.275 6.36868 numMergedOcc 0
19 mol 194 unq 0 iso 0 dist 6.26839 8.65535 5.92931 12.9377 10.0644 9.42308 14.0836 13.5578 15.0555 7.61316 numMergedOcc 0
20 mol 194 unq 1 iso 0 dist 8.83356 6.72379 7.50057 12.3879 10.0644 5.67863 15.834 13.5578 10.286 7.61316 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 9.007 7.32499 5.76537 13.1319 13.1702 9.38888 13.3467 17.1957 13.8349 7.72403 numMergedOcc 0
22 mol 234 unq 1 iso 0 dist 9.007 7.32499 5.76537 13.1319 13.1702 9.38888 10.3625 11.9788 10.0059 6.35438 numMergedOcc 0
23 mol 234 unq 2 iso 0 dist 9.007 7.32499 5.76537 13.1319 13.1702 9.38888 11.0622 4.778 5.08515 9.57132 numMergedOcc 0
24 mol 237 unq 0 iso 0 dist 6.50471 9.60163 6.12402 12.3471 10.8187 6.21939 19.1491 18.9193 13.3834 8.8949 numMergedOcc 0
25 mol 258 unq 0 iso 0 dist 9.1925 9.63959 4.22544 8.46375 10.0793 7.05518 10.5548 8.47336 5.63675 8.14531 numMergedOcc 0
26 mol 258 unq 1 iso 0 dist 6.70815 7.21311 8.10604 4.88549 10.8744 7.05518 6.60405 7.42673 5.63675 8.14531 numMergedOcc 0
