0 mol 24 unq 0 iso 0 dist 9.74777 11.9066 9.41655 13.8988 6.72423 8.62284 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 8.06843 5.85197 6.31089 8.60461 4.15828 5.38074 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 8.06843 7.47027 7.07502 8.60461 4.15828 9.07545 numMergedOcc 0
3 mol 28 unq 2 iso 0 dist 8.06843 5.11301 8.48468 8.60461 4.15828 6.77538 numMergedOcc 0
4 mol 30 unq 0 iso 0 dist 9.39194 5.24517 7.78893 11.7185 4.10948 8.58568 numMergedOcc 0
5 mol 30 unq 1 iso 0 dist 7.30322 5.24517 5.85146 11.7185 8.812 8.58568 numMergedOcc 0
6 mol 74 unq 0 iso 0 dist 8.4902 7.42971 8.42173 12.8213 8.31102 8.2657 numMergedOcc 0
7 mol 74 unq 1 iso 0 dist 8.30395 7.00308 8.42173 13.4207 8.31102 8.2657 numMergedOcc 0
8 mol 93 unq 0 iso 0 dist 8.61597 3.74136 6.46217 5.77804 11.5028 7.85041 numMergedOcc 0
9 mol 111 unq 0 iso 0 dist 8.51084 8.169 4.72339 14.3589 6.10261 7.92876 numMergedOcc 0
10 mol 111 unq 1 iso 0 dist 5.53271 8.169 7.21505 14.3589 13.0195 7.92876 numMergedOcc 0
11 mol 146 unq 0 iso 0 dist 8.91908 15.2833 8.71836 14.8163 8.77123 8.1069 numMergedOcc 0
12 mol 146 unq 1 iso 0 dist 8.91908 15.2833 8.71836 14.82 6.19717 8.68349 numMergedOcc 0
13 mol 147 unq 0 iso 0 dist 7.50372 4.52246 6.37938 6.36426 3.547 5.1101 numMergedOcc 0
14 mol 147 unq 1 iso 0 dist 7.50372 4.52246 6.37938 7.06711 9.88741 7.01133 numMergedOcc 0
15 mol 147 unq 2 iso 0 dist 5.79819 5.88056 7.19893 7.6489 7.97454 5.1101 numMergedOcc 0
16 mol 147 unq 3 iso 0 dist 5.79819 5.88056 7.19893 11.6758 13.3536 7.01133 numMergedOcc 0
17 mol 147 unq 4 iso 0 dist 6.03024 5.88056 6.37938 7.6489 3.547 5.1101 numMergedOcc 0
18 mol 147 unq 5 iso 0 dist 6.03024 5.88056 6.37938 11.6758 9.88741 7.01133 numMergedOcc 0
19 mol 158 unq 0 iso 0 dist 8.24681 7.85682 8.06621 11.1992 5.30823 6.39981 numMergedOcc 0
20 mol 158 unq 1 iso 0 dist 6.51748 4.19444 8.06621 7.63085 5.30823 6.39981 numMergedOcc 0
21 mol 205 unq 0 iso 0 dist 6.2669 10.0849 5.19567 9.70674 3.72865 5.42696 numMergedOcc 0
22 mol 210 unq 0 iso 0 dist 8.20259 11.4605 9.0259 10.9148 8.41803 9.53647 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 9.08818 12.5087 8.98941 12.3097 4.24855 6.86795 numMergedOcc 0
24 mol 218 unq 1 iso 0 dist 9.08818 12.5087 8.98941 12.1616 10.7049 6.61099 numMergedOcc 0
25 mol 218 unq 2 iso 0 dist 9.08818 9.82261 5.4621 12.3097 4.24855 6.23898 numMergedOcc 0
26 mol 230 unq 0 iso 0 dist 9.64987 5.33482 7.83105 12.2801 4.47722 8.85215 numMergedOcc 0
27 mol 230 unq 1 iso 0 dist 7.12149 5.33482 5.63025 12.2801 9.50055 8.85215 numMergedOcc 0
28 mol 255 unq 0 iso 0 dist 8.66655 5.94208 7.73503 7.60846 6.71212 6.6475 numMergedOcc 0
