0 mol 7 unq 0 iso 0 dist 7.15434 10.7937 8.72114 8.75346 9.67164 5.5683 12.8628 11.8172 6.02702 10.2465 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 6.4754 5.3298 7.18019 4.67793 9.01112 4.1204 10.2567 10.9495 7.03958 6.56356 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 6.4754 5.3298 7.18019 4.67793 9.01112 4.1204 11.9453 8.4069 8.53529 12.536 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 6.4754 5.3298 7.18019 4.67793 9.01112 4.1204 7.3795 6.23795 8.44009 7.62333 numMergedOcc 0
4 mol 8 unq 3 iso 0 dist 6.57999 7.97177 7.18019 11.5556 9.01112 4.1204 13.8619 10.9495 7.03958 6.56356 numMergedOcc 0
5 mol 8 unq 4 iso 0 dist 6.57999 7.97177 7.18019 11.5556 9.01112 4.1204 4.92734 8.4069 8.53529 12.536 numMergedOcc 0
6 mol 8 unq 5 iso 0 dist 6.57999 7.97177 7.18019 11.5556 9.01112 4.1204 12.3088 6.23795 8.44009 7.62333 numMergedOcc 0
7 mol 8 unq 6 iso 0 dist 7.3795 5.3298 8.44009 4.67793 7.62333 4.1204 10.2567 8.09332 7.03958 6.56356 numMergedOcc 0
8 mol 8 unq 7 iso 0 dist 7.3795 5.3298 8.44009 4.67793 7.62333 4.1204 11.9453 12.9016 8.53529 12.536 numMergedOcc 0
9 mol 8 unq 8 iso 0 dist 7.3795 5.3298 8.44009 4.67793 7.62333 4.1204 6.4754 6.23795 7.18019 9.01112 numMergedOcc 0
10 mol 9 unq 0 iso 0 dist 9.16444 5.86578 7.32257 6.92407 8.30653 10.6575 11.4615 6.14147 6.55811 13.3228 numMergedOcc 0
11 mol 9 unq 1 iso 0 dist 9.16444 5.86578 7.32257 6.92407 8.30653 10.6575 13.4922 10.5747 8.64915 16.2613 numMergedOcc 0
12 mol 24 unq 0 iso 0 dist 8.20058 13.4836 8.60554 12.0268 8.09311 15.4445 15.5985 14.6259 8.4051 20.3516 numMergedOcc 0
13 mol 24 unq 1 iso 0 dist 8.20058 13.4836 8.60554 12.0268 8.09311 15.4445 17.2959 10.0952 7.29868 16.0162 numMergedOcc 0
14 mol 24 unq 2 iso 0 dist 8.20058 13.4836 8.60554 9.10781 9.05357 11.8971 15.5985 14.6259 8.4051 12.5061 numMergedOcc 0
15 mol 24 unq 3 iso 0 dist 8.20058 13.4836 8.60554 9.10781 9.05357 11.8971 17.2959 10.0952 7.29868 16.8554 numMergedOcc 0
16 mol 24 unq 4 iso 0 dist 8.20058 9.04355 9.44691 12.0268 8.09311 13.0295 15.5985 14.6259 8.75662 20.3516 numMergedOcc 0
17 mol 24 unq 5 iso 0 dist 8.20058 9.04355 9.44691 9.10781 9.05357 4.02219 15.5985 14.6259 8.75662 12.5061 numMergedOcc 0
18 mol 25 unq 0 iso 0 dist 6.23095 12.1434 8.6653 11.9503 7.6114 10.8122 11.9439 10.6808 7.92503 16.617 numMergedOcc 0
19 mol 30 unq 0 iso 0 dist 9.28932 5.2347 7.12365 6.01658 6.07517 4.98558 6.83481 5.34368 8.1284 6.74179 numMergedOcc 0
20 mol 30 unq 1 iso 0 dist 7.53042 5.9029 7.12365 8.34136 6.07517 4.98558 11.534 5.34368 8.1284 6.74179 numMergedOcc 0
21 mol 30 unq 2 iso 0 dist 6.83481 5.2347 8.1284 6.01658 6.74179 4.98558 9.28932 5.34368 7.12365 6.07517 numMergedOcc 0
22 mol 100 unq 0 iso 0 dist 8.22596 6.21679 7.80975 12.9651 9.90751 15.0328 12.2079 10.8586 7.10378 15.6594 numMergedOcc 0
23 mol 100 unq 1 iso 0 dist 8.22596 6.21679 7.80975 13.0711 9.21662 12.48 12.2079 10.8586 7.10378 10.5432 numMergedOcc 0
24 mol 119 unq 0 iso 0 dist 8.62648 9.25614 6.52773 12.6962 7.64052 5.37917 11.5266 4.85907 9.11344 6.99446 numMergedOcc 0
25 mol 133 unq 0 iso 0 dist 9.79004 13.2968 7.71248 5.37122 8.26547 8.88402 14.9707 6.761 9.97654 12.4934 numMergedOcc 0
26 mol 133 unq 1 iso 0 dist 9.79004 13.2968 7.71248 5.37122 8.26547 8.88402 16.8376 7.6656 6.66772 13.5471 numMergedOcc 0
27 mol 181 unq 0 iso 0 dist 8.90247 6.56225 6.2479 11.9701 9.76212 6.39406 6.58792 6.01247 6.22122 8.59874 numMergedOcc 0
28 mol 181 unq 1 iso 0 dist 8.90247 6.56225 6.2479 11.9701 9.76212 6.39406 10.3907 8.88798 7.99195 13.2783 numMergedOcc 0
29 mol 181 unq 2 iso 0 dist 6.58792 6.56225 6.22122 11.9701 8.59874 6.39406 8.90247 6.01247 6.2479 9.76212 numMergedOcc 0
30 mol 181 unq 3 iso 0 dist 6.58792 6.56225 6.22122 11.9701 8.59874 6.39406 10.3907 12.6324 7.99195 13.2783 numMergedOcc 0
31 mol 195 unq 0 iso 0 dist 8.3705 11.3703 9.26504 4.29894 9.03441 8.29668 15.8199 10.7531 7.36683 14.2497 numMergedOcc 0
32 mol 213 unq 0 iso 0 dist 9.75141 10.9044 8.14332 4.53609 8.22569 6.60887 13.93 5.45334 7.73322 10.9843 numMergedOcc 0
