0 mol 41 unq 0 iso 0 dist 9.18013 5.36895 4.21535 14.9004 9.58184 11.3342 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 8.77251 7.62383 5.70356 5.75835 6.45963 6.03755 numMergedOcc 0
2 mol 55 unq 1 iso 0 dist 7.74299 7.62383 4.83051 5.75835 8.70819 6.03755 numMergedOcc 0
3 mol 55 unq 2 iso 0 dist 4.74307 6.81152 5.53748 5.36545 8.49449 6.25914 numMergedOcc 0
4 mol 55 unq 3 iso 0 dist 6.36082 6.81152 4.53728 5.36545 6.45963 6.25914 numMergedOcc 0
5 mol 90 unq 0 iso 0 dist 8.09741 9.25901 6.60114 7.71069 8.60438 12.7433 numMergedOcc 0
6 mol 90 unq 1 iso 0 dist 8.09741 7.96299 7.39819 7.71069 8.60438 12.8018 numMergedOcc 0
7 mol 94 unq 0 iso 0 dist 5.4622 8.01724 9.12104 5.88063 6.00639 13.3248 numMergedOcc 0
8 mol 220 unq 0 iso 0 dist 8.01913 8.14644 15.7646 8.2129 9.66105 14.9746 numMergedOcc 0
9 mol 220 unq 1 iso 0 dist 8.01913 8.14644 15.7646 6.4634 9.64006 8.9077 numMergedOcc 0
10 mol 230 unq 0 iso 0 dist 6.27573 6.03738 7.41279 7.95443 7.50128 12.5958 numMergedOcc 0
11 mol 236 unq 0 iso 0 dist 6.35418 9.07222 11.7774 7.55924 6.25412 13.3275 numMergedOcc 0
12 mol 236 unq 1 iso 0 dist 6.35418 9.09998 11.1911 7.55924 6.25412 15.0551 numMergedOcc 0
13 mol 256 unq 0 iso 0 dist 9.51909 9.51272 5.59478 9.39044 9.34785 7.54586 numMergedOcc 0
14 mol 271 unq 0 iso 0 dist 6.67008 7.9494 5.46826 10.9694 7.90629 12.3799 numMergedOcc 0
15 mol 281 unq 0 iso 0 dist 6.60861 9.27716 5.22248 8.1531 8.80931 13.8542 numMergedOcc 0
16 mol 281 unq 1 iso 0 dist 9.60142 9.37845 10.7592 5.98252 6.97131 9.64422 numMergedOcc 0
17 mol 294 unq 0 iso 0 dist 8.79534 7.77765 16.3624 11.231 7.15278 17.2419 numMergedOcc 0
