0 mol 9 unq 0 iso 0 dist 8.47421 8.55451 5.66192 8.27962 9.29529 13.2602 11.4878 7.2199 12.6418 5.80437 numMergedOcc 0
1 mol 9 unq 0 iso 1 dist 8.47421 8.55451 5.66192 11.4878 7.2199 12.6418 8.27962 9.29529 13.2602 5.80437 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 8.47421 5.8245 3.91075 8.27962 9.29529 9.71516 11.4878 7.2199 9.81658 5.80437 numMergedOcc 0
3 mol 9 unq 1 iso 1 dist 8.47421 5.8245 3.91075 11.4878 7.2199 9.81658 8.27962 9.29529 9.71516 5.80437 numMergedOcc 0
4 mol 32 unq 0 iso 0 dist 8.68559 7.26268 5.57199 7.93694 7.18766 10.1386 6.68431 7.48825 8.74576 9.61004 numMergedOcc 0
5 mol 32 unq 0 iso 1 dist 8.68559 7.26268 5.57199 6.68431 7.48825 8.74576 7.93694 7.18766 10.1386 9.61004 numMergedOcc 0
6 mol 39 unq 0 iso 0 dist 7.45237 8.70192 10.5834 6.42104 8.43814 14.3743 6.42248 8.16689 14.1214 6.26783 numMergedOcc 0
7 mol 39 unq 0 iso 1 dist 7.45237 8.70192 10.5834 6.42248 8.16689 14.1214 6.42104 8.43814 14.3743 6.26783 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 6.40841 8.69057 11.0945 4.55117 8.80108 7.03126 5.64209 6.50297 13.3982 7.57085 numMergedOcc 0
9 mol 58 unq 0 iso 1 dist 6.40841 8.69057 11.0945 5.64209 6.50297 13.3982 4.55117 8.80108 7.03126 7.57085 numMergedOcc 0
10 mol 58 unq 1 iso 0 dist 8.89374 8.96727 14.6599 12.7331 6.96494 20.5213 7.05413 7.01363 15.7229 6.49184 numMergedOcc 0
11 mol 58 unq 1 iso 1 dist 8.89374 8.96727 14.6599 7.05413 7.01363 15.7229 12.7331 6.96494 20.5213 6.49184 numMergedOcc 0
12 mol 58 unq 2 iso 0 dist 8.89374 8.01308 9.47022 12.7331 6.96494 16.0898 7.05413 7.01363 12.8612 6.49184 numMergedOcc 0
13 mol 58 unq 2 iso 1 dist 8.89374 8.01308 9.47022 7.05413 7.01363 12.8612 12.7331 6.96494 16.0898 6.49184 numMergedOcc 0
14 mol 72 unq 0 iso 0 dist 7.321 9.55118 6.74416 7.11552 9.19459 5.4605 7.17489 8.59747 6.7272 4.64409 numMergedOcc 0
15 mol 72 unq 0 iso 1 dist 7.321 9.55118 6.74416 7.17489 8.59747 6.7272 7.11552 9.19459 5.4605 4.64409 numMergedOcc 0
16 mol 72 unq 1 iso 0 dist 7.321 9.10345 5.63793 7.11552 9.19459 10.8476 7.17489 8.59747 7.64009 4.64409 numMergedOcc 0
17 mol 72 unq 1 iso 1 dist 7.321 9.10345 5.63793 7.17489 8.59747 7.64009 7.11552 9.19459 10.8476 4.64409 numMergedOcc 0
18 mol 114 unq 0 iso 0 dist 6.73814 5.7144 4.81369 12.1324 9.86739 10.4222 6.95201 8.39249 5.51885 7.68699 numMergedOcc 0
19 mol 114 unq 0 iso 1 dist 6.73814 5.7144 4.81369 6.95201 8.39249 5.51885 12.1324 9.86739 10.4222 7.68699 numMergedOcc 0
20 mol 114 unq 1 iso 0 dist 6.73814 5.7144 4.81369 12.1324 9.86739 10.4222 5.9968 8.93623 10.4626 11.9022 numMergedOcc 0
21 mol 114 unq 1 iso 1 dist 6.73814 5.7144 4.81369 5.9968 8.93623 10.4626 12.1324 9.86739 10.4222 11.9022 numMergedOcc 0
22 mol 114 unq 1 iso 0 dist 6.73814 5.7144 4.81369 6.95201 8.39249 5.51885 5.9968 8.93623 10.4626 10.0883 numMergedOcc 0
23 mol 114 unq 1 iso 1 dist 6.73814 5.7144 4.81369 5.9968 8.93623 10.4626 6.95201 8.39249 5.51885 10.0883 numMergedOcc 0
24 mol 115 unq 0 iso 0 dist 7.76729 6.24825 5.78043 6.34759 7.99631 10.2461 10.2377 6.40036 7.65255 9.37623 numMergedOcc 0
25 mol 115 unq 0 iso 1 dist 7.76729 6.24825 5.78043 10.2377 6.40036 7.65255 6.34759 7.99631 10.2461 9.37623 numMergedOcc 0
26 mol 155 unq 0 iso 0 dist 9.14392 8.97626 12.0485 6.3437 6.51096 13.5963 9.99927 8.73171 14.7426 6.0706 numMergedOcc 0
27 mol 155 unq 0 iso 1 dist 9.14392 8.97626 12.0485 9.99927 8.73171 14.7426 6.3437 6.51096 13.5963 6.0706 numMergedOcc 0
28 mol 225 unq 0 iso 0 dist 5.50387 8.1945 3.92979 10.7506 8.75834 8.91356 7.12954 9.36396 9.59574 15.6443 numMergedOcc 0
29 mol 225 unq 0 iso 1 dist 5.50387 8.1945 3.92979 7.12954 9.36396 9.59574 10.7506 8.75834 8.91356 15.6443 numMergedOcc 0
30 mol 234 unq 0 iso 0 dist 9.5707 7.81215 11.8229 5.56749 8.49841 9.11572 12.1076 9.6101 7.20293 10.9755 numMergedOcc 0
31 mol 234 unq 0 iso 1 dist 9.5707 7.81215 11.8229 12.1076 9.6101 7.20293 5.56749 8.49841 9.11572 10.9755 numMergedOcc 0
32 mol 250 unq 0 iso 0 dist 8.80086 6.59244 6.0473 11.0402 7.88284 12.379 7.26274 9.88279 11.304 6.17591 numMergedOcc 0
33 mol 250 unq 0 iso 1 dist 8.80086 6.59244 6.0473 7.26274 9.88279 11.304 11.0402 7.88284 12.379 6.17591 numMergedOcc 0
