0 mol 0 unq 0 iso 0 dist 9.16606 5.98788 13.0422 7.49611 15.8319 6.91778 numMergedOcc 0
1 mol 4 unq 0 iso 0 dist 5.39008 6.10734 5.12621 12.7044 9.12428 8.24634 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 9.46895 6.19304 12.7517 11.7888 18.1007 7.99969 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 6.29755 8.60653 11.1253 5.65405 9.89662 7.21717 numMergedOcc 0
4 mol 54 unq 1 iso 0 dist 7.4038 8.60653 10.063 5.65405 11.7963 7.21717 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 7.77128 5.67362 5.04866 5.46309 12.841 9.25641 numMergedOcc 0
6 mol 67 unq 0 iso 0 dist 9.25638 9.67641 10.4188 7.70042 15.168 9.49144 numMergedOcc 0
7 mol 67 unq 1 iso 0 dist 8.01856 9.67641 6.56501 7.70042 11.9613 9.49144 numMergedOcc 0
8 mol 96 unq 0 iso 0 dist 8.71026 9.87414 12.8509 6.21391 14.2413 8.39111 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 9.02712 9.93309 15.0618 10.4303 9.1146 9.22232 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 6.48475 5.24709 4.2484 7.11513 12.3811 9.14926 numMergedOcc 0
11 mol 156 unq 0 iso 0 dist 5.50879 8.32841 5.6621 10.9993 8.50926 9.00416 numMergedOcc 0
12 mol 156 unq 1 iso 0 dist 5.50879 6.00295 6.65278 9.26251 13.7542 8.73722 numMergedOcc 0
13 mol 156 unq 2 iso 0 dist 6.69157 6.10069 7.27063 5.84808 11.2481 6.30021 numMergedOcc 0
14 mol 156 unq 3 iso 0 dist 6.69157 6.10069 7.27063 9.92385 13.6661 9.47433 numMergedOcc 0
15 mol 156 unq 4 iso 0 dist 6.69157 6.56065 5.6621 4.75264 8.50926 9.00416 numMergedOcc 0
16 mol 184 unq 0 iso 0 dist 8.49577 6.65725 8.87236 7.25468 13.1625 6.42735 numMergedOcc 0
17 mol 226 unq 0 iso 0 dist 8.24741 6.82883 4.66376 12.6212 9.30975 8.80683 numMergedOcc 0
18 mol 226 unq 1 iso 0 dist 8.24741 6.82883 4.66376 10.78 9.14028 6.11704 numMergedOcc 0
19 mol 226 unq 2 iso 0 dist 8.24741 6.95495 13.3747 8.19889 12.2924 9.83827 numMergedOcc 0
20 mol 226 unq 3 iso 0 dist 5.07958 8.22518 4.66376 9.83787 9.30975 8.80683 numMergedOcc 0
21 mol 226 unq 4 iso 0 dist 5.07958 8.22518 4.66376 11.3247 9.14028 6.11704 numMergedOcc 0
22 mol 226 unq 5 iso 0 dist 6.19519 6.02803 4.66376 6.6871 9.30975 8.80683 numMergedOcc 0
23 mol 226 unq 6 iso 0 dist 6.19519 6.02803 4.66376 6.19485 9.14028 6.11704 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 5.77828 8.52162 4.04422 11.6549 11.4073 8.94014 numMergedOcc 0
25 mol 238 unq 1 iso 0 dist 5.77828 8.52162 4.04422 12.9109 10.6583 7.02333 numMergedOcc 0
26 mol 238 unq 2 iso 0 dist 5.77828 8.52162 4.04422 12.3128 11.147 8.67864 numMergedOcc 0
27 mol 244 unq 0 iso 0 dist 6.2667 5.60146 4.89551 8.82711 9.21656 5.50492 numMergedOcc 0
28 mol 273 unq 0 iso 0 dist 7.84151 8.16005 11.4694 6.69098 12.9809 8.49177 numMergedOcc 0
29 mol 273 unq 1 iso 0 dist 7.85797 8.16005 4.73332 6.69098 9.37841 8.49177 numMergedOcc 0
30 mol 287 unq 0 iso 0 dist 7.58907 8.53802 5.1517 14.2602 10.3838 6.89451 numMergedOcc 0
31 mol 288 unq 0 iso 0 dist 7.58907 8.53802 5.1517 14.2602 10.3838 6.89451 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 7.58907 8.53802 5.1517 14.2602 10.3838 6.89451 numMergedOcc 0
