0 mol 5 unq 0 iso 0 dist 7.62938 5.17677 7.64769 10.7685 4.73885 8.31759 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 7.62938 8.12453 8.68577 10.7685 4.73885 8.13672 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 7.62938 5.58988 9.70883 14.1058 16.0393 9.65565 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 5.92771 4.38299 3.77542 10.7473 9.4824 9.97314 numMergedOcc 0
4 mol 83 unq 0 iso 0 dist 6.72584 10.6239 6.96722 7.25594 5.72008 7.61085 numMergedOcc 0
5 mol 83 unq 1 iso 0 dist 7.25594 10.6239 7.61085 6.72584 5.72008 6.96722 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 8.93999 8.26567 6.98791 12.9731 5.26524 7.84207 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 9.85144 8.75597 5.36214 14.2713 8.29136 5.56127 numMergedOcc 0
8 mol 123 unq 1 iso 0 dist 9.85144 8.75597 5.36214 11.3337 13.0033 8.03692 numMergedOcc 0
9 mol 123 unq 2 iso 0 dist 5.80266 7.36026 5.36214 8.39986 8.29136 5.56127 numMergedOcc 0
10 mol 123 unq 3 iso 0 dist 5.80266 7.36026 5.36214 15.0739 13.0033 8.03692 numMergedOcc 0
11 mol 123 unq 4 iso 0 dist 5.18305 6.45068 5.56127 13.4965 10.2185 8.03692 numMergedOcc 0
12 mol 123 unq 5 iso 0 dist 5.18305 6.45068 5.56127 6.78431 8.29136 5.36214 numMergedOcc 0
13 mol 123 unq 6 iso 0 dist 6.78431 6.45068 5.36214 5.18305 8.29136 5.56127 numMergedOcc 0
14 mol 123 unq 7 iso 0 dist 6.78431 6.45068 5.36214 13.4965 13.0033 8.03692 numMergedOcc 0
15 mol 123 unq 8 iso 0 dist 6.60464 6.36283 5.36214 11.0811 8.29136 5.56127 numMergedOcc 0
16 mol 123 unq 9 iso 0 dist 6.60464 6.36283 5.36214 12.2214 13.0033 8.03692 numMergedOcc 0
17 mol 169 unq 0 iso 0 dist 9.03941 9.52806 5.10589 8.74324 5.23644 4.63336 numMergedOcc 0
18 mol 169 unq 1 iso 0 dist 9.03941 9.52806 5.10589 12.4365 7.52063 6.10715 numMergedOcc 0
19 mol 194 unq 0 iso 0 dist 9.06347 4.86105 5.10542 9.09359 3.78714 4.68722 numMergedOcc 0
20 mol 204 unq 0 iso 0 dist 7.00278 6.46602 8.32259 12.0267 8.59834 8.54737 numMergedOcc 0
21 mol 204 unq 1 iso 0 dist 7.00278 8.23616 9.93489 12.0267 8.59834 7.64057 numMergedOcc 0
22 mol 204 unq 2 iso 0 dist 8.50234 8.70089 8.54737 13.8302 8.59834 8.32259 numMergedOcc 0
23 mol 204 unq 3 iso 0 dist 8.50234 5.77393 7.64057 13.8302 8.59834 9.93489 numMergedOcc 0
24 mol 214 unq 0 iso 0 dist 7.81831 8.36583 7.96338 14.6179 10.5332 8.66082 numMergedOcc 0
25 mol 260 unq 0 iso 0 dist 8.56451 5.45648 7.04263 11.5412 8.76827 6.48099 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 9.02396 5.11028 7.8598 7.48115 3.00605 7.80711 numMergedOcc 0
27 mol 266 unq 1 iso 0 dist 9.02396 15.2885 8.25286 13.7319 5.76129 6.96692 numMergedOcc 0
28 mol 266 unq 2 iso 0 dist 9.02396 15.2885 8.25286 7.48115 3.00605 9.9965 numMergedOcc 0
29 mol 266 unq 3 iso 0 dist 7.48115 5.11028 7.80711 9.02396 3.00605 7.8598 numMergedOcc 0
30 mol 266 unq 4 iso 0 dist 7.48115 15.2885 9.9965 13.7319 8.75066 6.96692 numMergedOcc 0
31 mol 266 unq 5 iso 0 dist 7.48115 15.2885 9.9965 9.02396 3.00605 8.25286 numMergedOcc 0
32 mol 277 unq 0 iso 0 dist 9.00122 9.0121 6.79748 6.47907 3.75238 6.53598 numMergedOcc 0
33 mol 277 unq 1 iso 0 dist 6.47907 9.0121 6.53598 9.00122 3.75238 6.79748 numMergedOcc 0
