0 mol 26 unq 0 iso 0 dist 6.85245 9.15677 5.71065 15.7188 10.5415 6.73162 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.43571 9.61029 5.71065 7.95969 10.5415 6.73162 numMergedOcc 0
2 mol 42 unq 0 iso 0 dist 9.50568 7.06199 4.38082 6.56884 6.51963 7.41857 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 9.1695 7.51978 15.6611 5.59128 14.6744 5.02241 numMergedOcc 0
4 mol 86 unq 0 iso 0 dist 8.8236 5.49793 7.89966 4.51657 6.13833 7.79359 numMergedOcc 0
5 mol 131 unq 0 iso 0 dist 8.98949 9.69757 12.885 12.4356 19.4801 8.6243 numMergedOcc 0
6 mol 132 unq 0 iso 0 dist 8.58873 9.0339 5.28089 9.29705 10.501 6.03703 numMergedOcc 0
7 mol 132 unq 1 iso 0 dist 8.58873 8.48641 4.50065 9.29705 10.501 7.61505 numMergedOcc 0
8 mol 167 unq 0 iso 0 dist 8.68179 6.64164 7.9092 6.90242 14.4901 8.62646 numMergedOcc 0
9 mol 167 unq 1 iso 0 dist 5.32056 6.64164 6.45463 6.90242 11.5728 8.62646 numMergedOcc 0
10 mol 167 unq 2 iso 0 dist 9.52659 6.64164 6.67469 6.90242 10.0349 8.62646 numMergedOcc 0
11 mol 175 unq 0 iso 0 dist 8.88463 8.50904 6.93308 14.6248 16.0214 9.31887 numMergedOcc 0
12 mol 175 unq 1 iso 0 dist 8.88463 7.04318 6.01639 6.61225 13.716 9.0664 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 7.21606 6.96824 5.32364 5.54495 9.23089 6.93764 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 7.21606 9.25528 9.56466 14.3955 14.9822 6.94688 numMergedOcc 0
15 mol 181 unq 2 iso 0 dist 7.21606 9.25528 9.56466 15.6271 14.078 6.71012 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 6.9659 9.82174 5.48771 12.5765 10.6986 6.91569 numMergedOcc 0
17 mol 238 unq 1 iso 0 dist 8.09547 7.2527 4.98461 14.0776 14.1184 9.90142 numMergedOcc 0
18 mol 238 unq 2 iso 0 dist 8.09547 7.13194 13.3052 14.751 17.123 9.29858 numMergedOcc 0
19 mol 238 unq 3 iso 0 dist 8.66923 9.29203 15.3346 11.091 12.6015 9.90142 numMergedOcc 0
20 mol 238 unq 4 iso 0 dist 8.66923 7.62771 13.1885 12.4266 10.5557 9.68513 numMergedOcc 0
21 mol 238 unq 5 iso 0 dist 8.66923 7.62771 13.1885 11.091 12.6015 5.9216 numMergedOcc 0
22 mol 238 unq 6 iso 0 dist 8.66923 7.80166 7.04671 12.4266 10.5557 9.29858 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 9.71269 7.28096 5.09322 9.67343 11.9954 7.04472 numMergedOcc 0
24 mol 287 unq 1 iso 0 dist 9.71269 7.28096 5.09322 6.32031 8.11173 6.4778 numMergedOcc 0
25 mol 287 unq 2 iso 0 dist 9.40407 7.28096 12.3043 9.67343 14.301 7.04472 numMergedOcc 0
26 mol 287 unq 3 iso 0 dist 9.40407 7.28096 12.3043 6.32031 14.677 6.4778 numMergedOcc 0
27 mol 288 unq 0 iso 0 dist 9.71269 7.28096 5.09322 9.67343 11.9954 7.04472 numMergedOcc 0
28 mol 288 unq 1 iso 0 dist 9.71269 7.28096 5.09322 6.32031 8.11173 6.4778 numMergedOcc 0
29 mol 288 unq 2 iso 0 dist 9.40407 7.28096 12.3043 9.67343 14.301 7.04472 numMergedOcc 0
30 mol 288 unq 3 iso 0 dist 9.40407 7.28096 12.3043 6.32031 14.677 6.4778 numMergedOcc 0
31 mol 289 unq 0 iso 0 dist 9.71269 7.28096 5.09322 9.67343 11.9954 7.04472 numMergedOcc 0
32 mol 289 unq 1 iso 0 dist 9.71269 7.28096 5.09322 6.32031 8.11173 6.4778 numMergedOcc 0
33 mol 289 unq 2 iso 0 dist 9.40407 7.28096 12.3043 9.67343 14.301 7.04472 numMergedOcc 0
34 mol 289 unq 3 iso 0 dist 9.40407 7.28096 12.3043 6.32031 14.677 6.4778 numMergedOcc 0
35 mol 293 unq 0 iso 0 dist 8.84911 8.90008 12.7881 11.8919 14.6536 8.56847 numMergedOcc 0
