0 mol 26 unq 0 iso 0 dist 9.19362 9.56639 10.3466 9.89914 4.64353 11.3766 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 5.07365 8.47386 4.56364 6.93709 6.59787 5.27648 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.44329 5.55479 6.76467 9.36493 4.62291 11.2499 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 6.44329 5.55479 6.76467 9.0665 5.28477 7.20258 numMergedOcc 0
4 mol 34 unq 2 iso 0 dist 6.44329 5.55479 6.76467 7.07773 10.6246 6.48477 numMergedOcc 0
5 mol 34 unq 3 iso 0 dist 8.94846 5.55479 14.3065 9.36493 12.295 11.2499 numMergedOcc 0
6 mol 34 unq 4 iso 0 dist 8.94846 5.55479 14.3065 9.0665 16.5713 7.20258 numMergedOcc 0
7 mol 34 unq 5 iso 0 dist 8.94846 5.55479 14.3065 7.07773 14.9436 6.48477 numMergedOcc 0
8 mol 44 unq 0 iso 0 dist 8.99723 9.99671 11.257 9.80946 14.5467 5.33571 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 9.97253 6.63733 13.3318 4.5892 10.5865 3.07021 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 9.7137 9.05604 6.98893 7.68838 14.4664 9.79375 numMergedOcc 0
11 mol 109 unq 1 iso 0 dist 9.7137 5.58623 11.231 7.68838 14.4664 3.54756 numMergedOcc 0
12 mol 116 unq 0 iso 0 dist 8.60347 9.17843 7.97496 7.70636 4.58282 3.43966 numMergedOcc 0
13 mol 116 unq 1 iso 0 dist 9.29956 7.31364 7.97496 6.82267 4.58282 3.43966 numMergedOcc 0
14 mol 117 unq 0 iso 0 dist 9.14994 8.54233 7.5937 8.16392 15.1381 9.7683 numMergedOcc 0
15 mol 135 unq 0 iso 0 dist 7.084 7.29835 6.29826 6.63808 4.47406 4.98191 numMergedOcc 0
16 mol 135 unq 1 iso 0 dist 7.084 8.08732 8.98275 6.63808 4.47406 5.83178 numMergedOcc 0
17 mol 171 unq 0 iso 0 dist 9.48469 6.52368 6.6634 6.93017 5.78883 3.51753 numMergedOcc 0
