0 mol 4 unq 0 iso 0 dist 5.39008 12.7044 9.12428 6.00772 5.93454 12.0855 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 6.96907 5.12111 5.68648 6.68292 8.59067 4.94497 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 5.45684 11.6779 8.75668 6.11938 5.94373 6.21578 numMergedOcc 0
3 mol 64 unq 1 iso 0 dist 5.45684 12.0048 9.64871 6.11938 5.94373 11.4485 numMergedOcc 0
4 mol 64 unq 2 iso 0 dist 5.45684 10.7116 9.95118 6.11938 5.94373 13.1551 numMergedOcc 0
5 mol 64 unq 3 iso 0 dist 7.76644 10.1207 8.75668 4.43442 5.94373 6.21578 numMergedOcc 0
6 mol 64 unq 4 iso 0 dist 7.76644 15.2828 9.64871 4.43442 5.94373 11.4485 numMergedOcc 0
7 mol 64 unq 5 iso 0 dist 7.76644 15.7534 9.95118 4.43442 5.94373 13.1551 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 9.8089 11.524 8.0139 5.63508 5.72627 7.23157 numMergedOcc 0
9 mol 79 unq 1 iso 0 dist 9.8089 11.524 8.0139 9.73669 7.68741 12.5946 numMergedOcc 0
10 mol 79 unq 2 iso 0 dist 9.8089 11.524 8.0139 6.00867 9.86085 14.3663 numMergedOcc 0
11 mol 79 unq 3 iso 0 dist 9.8089 11.524 8.0139 12.6221 9.76351 9.69296 numMergedOcc 0
12 mol 156 unq 0 iso 0 dist 5.50879 10.9993 8.50926 5.309 8.75305 10.8404 numMergedOcc 0
13 mol 156 unq 1 iso 0 dist 5.50879 10.9993 8.50926 6.07262 5.13522 5.18356 numMergedOcc 0
14 mol 156 unq 2 iso 0 dist 6.69157 4.75264 8.50926 11.9245 8.75305 10.8404 numMergedOcc 0
15 mol 156 unq 3 iso 0 dist 6.69157 4.75264 8.50926 6.25291 5.13522 5.18356 numMergedOcc 0
16 mol 198 unq 0 iso 0 dist 7.62505 6.95439 9.19061 9.96095 9.60514 11.1439 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 9.23669 15.0515 9.44947 10.389 7.59757 5.86489 numMergedOcc 0
18 mol 209 unq 0 iso 0 dist 8.8886 11.2558 9.62543 5.54278 8.76128 6.552 numMergedOcc 0
19 mol 209 unq 1 iso 0 dist 8.78565 12.9345 9.62543 9.814 8.76128 6.552 numMergedOcc 0
20 mol 211 unq 0 iso 0 dist 9.24739 7.59113 9.26395 4.98995 9.55972 5.69622 numMergedOcc 0
21 mol 211 unq 1 iso 0 dist 9.24739 11.3709 7.3748 4.98995 9.55972 8.87966 numMergedOcc 0
22 mol 212 unq 0 iso 0 dist 7.98724 6.09177 9.55058 12.3018 6.80332 10.5131 numMergedOcc 0
23 mol 212 unq 1 iso 0 dist 7.98724 6.09177 9.55058 12.9081 7.64336 10.3396 numMergedOcc 0
24 mol 226 unq 0 iso 0 dist 8.24741 12.6212 9.30975 4.97624 6.45143 7.92585 numMergedOcc 0
25 mol 226 unq 1 iso 0 dist 8.24741 10.78 9.14028 4.97624 6.45143 7.554 numMergedOcc 0
26 mol 226 unq 2 iso 0 dist 5.07958 9.83787 9.30975 5.55393 6.45143 7.92585 numMergedOcc 0
27 mol 226 unq 3 iso 0 dist 5.07958 11.3247 9.14028 5.55393 6.45143 7.554 numMergedOcc 0
28 mol 226 unq 4 iso 0 dist 6.19519 6.6871 9.30975 9.35407 6.45143 7.92585 numMergedOcc 0
29 mol 226 unq 5 iso 0 dist 6.19519 6.19485 9.14028 9.35407 6.45143 7.554 numMergedOcc 0
30 mol 241 unq 0 iso 0 dist 8.89435 10.0597 7.73213 5.71704 5.6297 4.90279 numMergedOcc 0
31 mol 273 unq 0 iso 0 dist 7.85797 6.69098 9.37841 5.63899 9.65597 4.60101 numMergedOcc 0
