0 mol 9 unq 0 iso 0 dist 9.99657 14.634 8.59513 21.8118 17.4864 9.05556 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 9.99657 12.8646 6.59312 19.8653 16.0747 9.63377 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 9.99657 12.8646 6.59312 15.1801 5.38864 8.35098 numMergedOcc 0
3 mol 10 unq 0 iso 0 dist 8.44864 10.0703 7.8329 14.2528 5.94028 9.6581 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 9.45566 12.2887 6.53981 11.13 6.51988 9.78501 numMergedOcc 0
5 mol 135 unq 0 iso 0 dist 5.43728 11.2315 8.72359 10.4407 5.14857 8.62814 numMergedOcc 0
6 mol 135 unq 1 iso 0 dist 5.43728 3.47015 7.02963 10.5852 8.53327 8.78439 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 7.6793 7.06015 6.90583 6.32669 4.8653 7.53168 numMergedOcc 0
8 mol 141 unq 1 iso 0 dist 7.6793 6 6.75593 6.32669 4.8653 5.18805 numMergedOcc 0
9 mol 141 unq 2 iso 0 dist 7.6793 8.90391 8.83562 6.32669 4.8653 7.11158 numMergedOcc 0
10 mol 168 unq 0 iso 0 dist 8.90876 7.13766 6.12453 15.0381 10.8621 7.93917 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 5.66363 3.55808 9.20617 6.13872 9.21613 6.19329 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 5.97968 6.33098 9.20617 10.1001 9.21613 6.19329 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 8.50382 12.4553 9.20617 15.9414 9.21613 6.19329 numMergedOcc 0
14 mol 181 unq 3 iso 0 dist 8.63119 8.9845 9.20617 11.3254 9.21613 6.19329 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 5.86419 3.83801 7.75318 6.09754 5.42117 5.32465 numMergedOcc 0
16 mol 205 unq 1 iso 0 dist 7.23557 9.4797 7.75318 10.7582 5.42117 5.32465 numMergedOcc 0
17 mol 205 unq 2 iso 0 dist 8.86587 13.314 7.75318 13.5379 5.42117 5.32465 numMergedOcc 0
18 mol 249 unq 0 iso 0 dist 6.58109 14.8497 8.76518 16.4542 10.4369 9.38713 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 8.63176 10.3385 9.36974 9.4886 8.01004 9.30975 numMergedOcc 0
20 mol 273 unq 0 iso 0 dist 6.38341 10.2963 9.81919 10.9089 5.62662 8.5948 numMergedOcc 0
