0 mol 61 unq 0 iso 0 dist 8.46313 9.46304 6.72123 10.0824 4.78811 8.44473 numMergedOcc 0
1 mol 100 unq 0 iso 0 dist 7.02792 11.4302 9.35224 14.0153 10.3954 7.689 numMergedOcc 0
2 mol 100 unq 1 iso 0 dist 7.02792 6.20162 6.56369 9.25746 4.95357 9.22737 numMergedOcc 0
3 mol 129 unq 0 iso 0 dist 6.1421 7.86921 8.54584 11.9332 10.4463 9.1987 numMergedOcc 0
4 mol 129 unq 1 iso 0 dist 9.06272 10.7142 5.83384 5.92115 6.13737 8.59695 numMergedOcc 0
5 mol 129 unq 2 iso 0 dist 9.06272 10.7142 5.83384 13.9064 5.12351 6.42706 numMergedOcc 0
6 mol 129 unq 3 iso 0 dist 9.54663 6.95124 8.54584 15.5018 10.4463 9.1987 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 7.85025 4.26332 6.29155 5.50699 9.74121 8.97762 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 7.85025 13.8058 8.00618 16.1808 9.67676 9.47554 numMergedOcc 0
9 mol 182 unq 0 iso 0 dist 7.21035 8.27436 9.31746 13.8356 13.1207 9.06702 numMergedOcc 0
10 mol 229 unq 0 iso 0 dist 9.68636 5.6419 7.03423 12.5719 9.15968 8.83023 numMergedOcc 0
11 mol 229 unq 1 iso 0 dist 7.81415 5.6419 9.06952 12.5719 10.6678 8.83023 numMergedOcc 0
12 mol 234 unq 0 iso 0 dist 9.5181 9.15708 9.36357 13.6128 11.7817 5.46736 numMergedOcc 0
13 mol 236 unq 0 iso 0 dist 6.0087 12.338 6.84306 9.68784 5.03564 6.61371 numMergedOcc 0
14 mol 236 unq 1 iso 0 dist 6.0087 12.431 9.99038 17.5484 13.6195 5.90804 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 5.27188 5.34337 7.32223 8.08267 5.32928 8.82388 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 9.80417 10.759 6.60405 17.8659 8.81588 9.04358 numMergedOcc 0
17 mol 276 unq 0 iso 0 dist 6.97104 12.2532 9.8993 16.9504 11.2406 8.15803 numMergedOcc 0
18 mol 276 unq 1 iso 0 dist 8.63281 12.388 9.8993 17.6876 11.2406 8.15803 numMergedOcc 0
