0 mol 34 unq 0 iso 0 dist 9.52614 6.87871 10.4854 6.40741 7.54933 8.04976 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 9.52614 6.87871 10.4854 9.31366 5.10934 9.01679 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.96621 7.54318 10.3987 9.46554 9.78936 7.45459 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 7.59354 9.59261 6.83826 4.96613 11.3708 11.3905 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 7.59354 6.67936 9.94628 4.96613 11.3708 4.67519 numMergedOcc 0
5 mol 98 unq 2 iso 0 dist 7.59354 8.25817 7.53156 4.96613 11.3708 10.4027 numMergedOcc 0
6 mol 108 unq 0 iso 0 dist 7.52802 7.29462 12.8858 6.80069 3.82616 10.1805 numMergedOcc 0
7 mol 108 unq 1 iso 0 dist 8.1971 7.29462 9.53351 6.80069 7.52989 10.1805 numMergedOcc 0
8 mol 108 unq 2 iso 0 dist 7.84262 7.29462 12.0135 6.80069 11.1894 10.1805 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.09095 9.93703 11.2951 6.13508 6.4025 7.45148 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 9.40633 8.53368 11.3008 5.58734 6.25204 6.36778 numMergedOcc 0
11 mol 119 unq 2 iso 0 dist 9.42432 8.53368 5.35931 5.58734 4.90636 6.36778 numMergedOcc 0
12 mol 119 unq 3 iso 0 dist 9.22776 8.53368 5.90895 5.58734 5.8134 6.36778 numMergedOcc 0
13 mol 130 unq 0 iso 0 dist 6.00391 8.54461 9.38606 5.05277 5.14963 6.66056 numMergedOcc 0
14 mol 130 unq 1 iso 0 dist 6.00391 7.83619 11.8666 5.05277 5.14963 7.11959 numMergedOcc 0
15 mol 130 unq 2 iso 0 dist 9.70695 8.54461 6.33857 5.05277 9.3746 6.66056 numMergedOcc 0
16 mol 130 unq 3 iso 0 dist 9.70695 7.83619 5.15286 5.05277 9.3746 7.11959 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 8.60913 8.84018 14.8033 8.70392 6.21732 17.168 numMergedOcc 0
18 mol 143 unq 0 iso 0 dist 8.99696 9.61081 15.534 5.75595 6.48478 10.0059 numMergedOcc 0
19 mol 143 unq 1 iso 0 dist 8.99696 5.46922 13.763 5.75595 6.48478 8.57817 numMergedOcc 0
20 mol 156 unq 0 iso 0 dist 8.24004 6.71202 4.08699 6.22667 5.0315 6.03934 numMergedOcc 0
21 mol 183 unq 0 iso 0 dist 8.74697 7.31181 14.6339 5.5781 8.80123 6.59099 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 8.23071 9.75313 10.9485 6.48885 6.47466 10.7174 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 7.34709 8.77254 10.6351 9.85348 5.50477 8.84434 numMergedOcc 0
24 mol 236 unq 1 iso 0 dist 7.34709 9.96976 12.8976 9.85348 5.50477 10.1697 numMergedOcc 0
25 mol 259 unq 0 iso 0 dist 6.13752 6.77279 6.59107 9.69025 10.5467 8.41846 numMergedOcc 0
26 mol 259 unq 1 iso 0 dist 6.13752 9.58006 11.1778 9.69025 10.5467 8.81835 numMergedOcc 0
27 mol 278 unq 0 iso 0 dist 5.12827 9.82774 9.40662 8.20933 5.39083 14.3412 numMergedOcc 0
