0 mol 7 unq 0 iso 0 dist 5.77374 9.30196 6.0323 10.9529 5.96526 8.05125 9.8603 5.70161 7.15434 9.17482 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.84857 8.57713 9.58865 12.9429 5.42241 8.40995 13.7405 8.54694 7.32392 4.77411 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.10386 14.2654 7.02351 10.2641 5.4653 6.7939 13.2599 11.2674 8.16299 7.80518 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.10386 14.2654 7.02351 12.5369 4.63063 6.85356 13.2599 11.2674 8.16299 11.6012 numMergedOcc 0
4 mol 101 unq 0 iso 0 dist 5.5199 5.2394 5.51185 9.83562 4.84084 7.11476 9.90517 4.79998 9.3485 4.59715 numMergedOcc 0
5 mol 124 unq 0 iso 0 dist 7.83509 8.00585 5.61764 11.7109 5.26643 8.03603 12.4558 5.31501 6.35314 5.1738 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 8.89412 10.3282 7.8034 13.2933 9.45822 9.14809 15.0465 8.25445 9.33945 14.651 numMergedOcc 0
7 mol 131 unq 1 iso 0 dist 8.89412 10.3282 7.8034 16.1271 10.1774 6.45169 15.0465 8.25445 9.33945 7.47571 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 9.49104 12.0027 9.21999 15.9043 10.6104 6.00896 13.0519 10.3334 6.54987 4.8408 numMergedOcc 0
9 mol 218 unq 0 iso 0 dist 6.2441 6.7488 5.98076 11.6868 10.7072 9.11823 6.9398 8.31343 4.851 5.97687 numMergedOcc 0
10 mol 230 unq 0 iso 0 dist 6.61442 6.22182 5.00735 10.4744 4.85368 9.32781 11.5522 7.07028 5.62804 9.33469 numMergedOcc 0
11 mol 230 unq 1 iso 0 dist 6.61442 6.22182 5.00735 10.4744 4.85368 9.32781 15.2718 11.491 9.3619 14.1107 numMergedOcc 0
12 mol 230 unq 2 iso 0 dist 7.10283 5.18766 5.00735 10.321 4.85368 9.32781 9.97386 7.07028 5.62804 9.33469 numMergedOcc 0
13 mol 230 unq 3 iso 0 dist 7.10283 5.18766 5.00735 10.321 4.85368 9.32781 14.3186 11.491 9.3619 14.1107 numMergedOcc 0
14 mol 252 unq 0 iso 0 dist 8.63848 9.75362 7.74647 10.5035 7.39139 4.91772 6.1197 4.98533 6.41821 4.90903 numMergedOcc 0
15 mol 256 unq 0 iso 0 dist 9.37687 4.19031 8.11884 9.99628 10.2154 9.92947 7.67598 9.07441 5.98967 4.85574 numMergedOcc 0
