0 mol 8 unq 0 iso 0 dist 9.52805 5.89089 5.12111 7.32214 9.03822 7.92414 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.52805 5.89089 5.12111 6.32494 11.9427 6.82379 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 9.52805 9.78638 10.7532 6.32494 11.9427 6.24978 numMergedOcc 0
3 mol 52 unq 0 iso 0 dist 5.77748 9.02308 10.3287 6.10615 11.7647 9.9052 numMergedOcc 0
4 mol 52 unq 1 iso 0 dist 7.62062 9.6112 6.03647 7.56616 11.5664 9.9052 numMergedOcc 0
5 mol 52 unq 2 iso 0 dist 7.33436 6.08894 6.03647 4.34047 11.5664 9.9052 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 8.91629 6.44766 5.29825 13.6401 12.0195 9.29384 numMergedOcc 0
7 mol 180 unq 0 iso 0 dist 7.11542 7.24785 6.93557 9.54991 13.0248 9.18528 numMergedOcc 0
8 mol 180 unq 1 iso 0 dist 6.43834 7.53287 6.93557 7.78726 13.0248 9.18528 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 6.03801 5.47189 8.61343 9.40342 13.0447 7.20574 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 9.92602 6.20985 5.93294 8.93951 5.31166 7.24795 numMergedOcc 0
11 mol 186 unq 2 iso 0 dist 9.08415 7.69466 5.93294 5.99908 5.31166 7.24795 numMergedOcc 0
12 mol 229 unq 0 iso 0 dist 7.68999 9.68636 5.65373 7.82856 11.5087 8.92743 numMergedOcc 0
13 mol 234 unq 0 iso 0 dist 8.70264 8.58958 7.01488 14.2602 9.91928 8.24186 numMergedOcc 0
14 mol 234 unq 1 iso 0 dist 8.70264 7.17987 7.54044 14.2602 9.91928 7.5366 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 8.65727 9.80417 15.3755 9.31209 17.0695 6.70815 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 9.77903 6.38062 5.59624 5.01803 11.0972 9.74402 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 9.39145 6.38062 11.3986 5.01803 13.8823 9.74402 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 9.77903 6.38062 5.59624 5.01803 11.0972 9.74402 numMergedOcc 0
19 mol 288 unq 1 iso 0 dist 9.39145 6.38062 11.3986 5.01803 13.8823 9.74402 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 9.77903 6.38062 5.59624 5.01803 11.0972 9.74402 numMergedOcc 0
21 mol 289 unq 1 iso 0 dist 9.39145 6.38062 11.3986 5.01803 13.8823 9.74402 numMergedOcc 0
22 mol 294 unq 0 iso 0 dist 9.83069 5.71661 13.8637 6.89875 12.2479 7.91611 numMergedOcc 0
