0 mol 28 unq 0 iso 0 dist 5.9948 6.76158 11.7233 9.86606 13.8518 7.82759 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 7.19406 7.12713 9.83606 8.18746 13.1533 8.99393 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 8.99618 6.45955 9.93156 7.49788 15.7315 7.75075 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 7.18358 6.29801 5.73969 5.81115 6.96066 4.5892 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 4.3761 5.61418 9.39313 11.3093 12.2487 8.73798 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 4.3761 5.61418 9.39313 6.41542 8.04448 5.24616 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 6.31509 5.91023 4.48773 10.5613 10.1506 5.85622 numMergedOcc 0
7 mol 98 unq 3 iso 0 dist 6.14782 5.91023 3.8493 10.5613 8.18252 5.85622 numMergedOcc 0
8 mol 98 unq 4 iso 0 dist 8.49806 5.91023 3.78499 10.5613 7.55531 5.85622 numMergedOcc 0
9 mol 98 unq 5 iso 0 dist 5.84583 5.61418 6.66668 11.3093 14.5912 8.73798 numMergedOcc 0
10 mol 98 unq 6 iso 0 dist 5.84583 5.61418 6.66668 6.41542 10.6866 5.24616 numMergedOcc 0
11 mol 135 unq 0 iso 0 dist 6.1777 6.08242 3.47015 10.6501 9.72782 6.63808 numMergedOcc 0
12 mol 135 unq 1 iso 0 dist 6.29701 5.60595 3.47015 7.97354 9.72782 6.63808 numMergedOcc 0
13 mol 176 unq 0 iso 0 dist 6.55106 6.32254 3.58164 11.3492 10.6184 9.95907 numMergedOcc 0
14 mol 176 unq 1 iso 0 dist 8.08891 8.89556 3.58164 9.65515 10.6184 9.95907 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 9.75853 9.02402 14.845 6.4779 15.4 5.70056 numMergedOcc 0
16 mol 243 unq 0 iso 0 dist 9.6748 8.35328 3.79865 5.52989 9.85847 7.6142 numMergedOcc 0
17 mol 243 unq 1 iso 0 dist 8.71177 8.35328 8.58943 5.52989 12.5064 7.6142 numMergedOcc 0
18 mol 260 unq 0 iso 0 dist 4.76689 6.02628 3.43711 5.42082 6.23198 4.20369 numMergedOcc 0
19 mol 260 unq 1 iso 0 dist 7.26455 6.02628 7.63469 5.42082 8.82216 4.20369 numMergedOcc 0
