0 mol 26 unq 0 iso 0 dist 7.24022 7.37634 3.38988 6.21692 5.71245 7.26165 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 9.53862 7.51631 15.0083 9.04231 18.2153 5.57551 numMergedOcc 0
2 mol 68 unq 1 iso 0 dist 6.88001 4.9983 11.023 5.16912 9.073 8.18214 numMergedOcc 0
3 mol 68 unq 2 iso 0 dist 6.88001 7.51631 10.2302 9.04231 14.2766 5.57551 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 9.30739 5.38363 11.2122 11.5849 16.3769 9.56859 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 9.30739 5.38363 11.2122 5.10938 9.34288 5.75135 numMergedOcc 0
6 mol 70 unq 0 iso 0 dist 4.86511 9.87737 10.4666 6.11801 10.7022 9.79317 numMergedOcc 0
7 mol 70 unq 1 iso 0 dist 4.86511 6.7303 7.63128 6.11801 10.7022 7.69436 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 7.61296 6.36631 5.70681 8.77924 10.1152 7.96893 numMergedOcc 0
9 mol 169 unq 0 iso 0 dist 9.17931 7.07933 5.88521 14.3008 10.4838 7.33643 numMergedOcc 0
10 mol 214 unq 0 iso 0 dist 9.67898 6.26596 7.25055 12.2386 13.1004 9.68612 numMergedOcc 0
11 mol 235 unq 0 iso 0 dist 9.5095 5.49475 4.65306 6.15704 14.2525 9.82099 numMergedOcc 0
12 mol 235 unq 1 iso 0 dist 9.08448 8.28824 13.1366 9.7911 14.7832 8.1174 numMergedOcc 0
13 mol 235 unq 2 iso 0 dist 9.08448 7.8548 14.6217 7.64186 13.7989 9.82099 numMergedOcc 0
14 mol 254 unq 0 iso 0 dist 8.85328 9.31593 7.43463 10.7808 15.192 9.09568 numMergedOcc 0
15 mol 254 unq 1 iso 0 dist 8.85328 9.31593 7.43463 4.78244 10.8819 7.84221 numMergedOcc 0
16 mol 254 unq 2 iso 0 dist 7.46584 9.31593 11.49 10.7808 17.1133 9.09568 numMergedOcc 0
17 mol 254 unq 3 iso 0 dist 7.46584 9.31593 11.49 4.78244 11.2547 7.84221 numMergedOcc 0
18 mol 257 unq 0 iso 0 dist 9.80634 6.73777 5.83544 14.832 13.623 9.82105 numMergedOcc 0
19 mol 270 unq 0 iso 0 dist 8.77116 7.96508 13.2466 8.5694 17.0054 8.76202 numMergedOcc 0
20 mol 270 unq 1 iso 0 dist 7.18907 7.96508 11.0423 8.5694 13.4877 8.76202 numMergedOcc 0
