0 mol 0 unq 0 iso 0 dist 7.92928 5.75315 11.2254 6.0597 10.8762 9.00092 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.48645 5.75315 6.90471 6.0597 6.64713 9.00092 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.5404 8.53931 11.7199 6.06874 11.4352 6.53269 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 8.5404 8.53931 11.7199 5.16935 12.7621 9.81524 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 9.25649 5.84066 14.3725 4.98603 12.2636 6.07276 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 9.36104 5.84066 11.3426 4.98603 13.7693 6.07276 numMergedOcc 0
6 mol 26 unq 2 iso 0 dist 8.42581 9.06516 9.45442 11.553 6.74848 6.81793 numMergedOcc 0
7 mol 26 unq 3 iso 0 dist 8.42581 6.79475 4.39827 7.26595 13.6618 9.96912 numMergedOcc 0
8 mol 56 unq 0 iso 0 dist 5.86571 9.35784 9.20886 6.56778 6.99108 9.54323 numMergedOcc 0
9 mol 59 unq 0 iso 0 dist 8.72896 6.52887 6.9277 5.80538 12.2818 8.65144 numMergedOcc 0
10 mol 59 unq 1 iso 0 dist 6.62481 6.52887 6.94466 5.80538 11.7746 8.65144 numMergedOcc 0
11 mol 68 unq 0 iso 0 dist 8.80104 7.95451 9.40469 12.9103 14.5373 7.98985 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 9.05798 9.08536 13.2984 15.4934 20.5445 8.67537 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 9.87025 6.13374 6.29394 7.39626 14.7366 8.67537 numMergedOcc 0
14 mol 119 unq 2 iso 0 dist 5.85818 9.08536 6.29394 15.4934 14.7366 8.67537 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 8.07135 8.55349 9.82696 11.5342 17.1955 8.83732 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 8.77898 5.73203 12.9744 12.2578 15.7897 7.83568 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 7.2498 9.58372 11.6757 10.8576 15.5296 5.44533 numMergedOcc 0
18 mol 218 unq 0 iso 0 dist 9.67381 8.61306 13.7733 9.52657 18.4248 8.57119 numMergedOcc 0
19 mol 218 unq 1 iso 0 dist 6.61099 8.61306 13.0451 9.52657 14.4729 8.57119 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 9.06084 7.20293 11.7392 4.51304 11.4382 7.77911 numMergedOcc 0
