0 mol 10 unq 0 iso 0 dist 9.6309 13.4978 7.83083 13.2906 8.3613 5.4053 19.1898 15.0188 9.29504 14.5213 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 8.76873 13.5119 7.83083 11.4971 8.3613 5.4053 21.0904 15.0188 9.29504 14.5213 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 9.58981 10.6599 7.83083 6.38082 8.3613 5.4053 19.5034 15.0188 9.29504 14.5213 numMergedOcc 0
3 mol 10 unq 3 iso 0 dist 9.23414 13.4978 6.90469 13.2906 9.33141 5.4053 19.1898 12.4341 9.29504 14.5213 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 6.46582 4.00834 5.91098 8.78063 7.61521 10.2219 7.41861 8.58474 7.48127 14.6364 numMergedOcc 0
5 mol 122 unq 0 iso 0 dist 6.80798 6.25432 4.821 4.42285 4.42563 6.28781 13.8174 7.33765 8.9864 11.3383 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 7.84813 5.0466 4.4077 5.56946 7.97548 4.80675 6.65878 6.61102 7.6453 8.00624 numMergedOcc 0
7 mol 129 unq 1 iso 0 dist 7.84813 5.0466 4.4077 6.4379 9.9291 5.57362 6.65878 6.61102 7.6453 11.5175 numMergedOcc 0
8 mol 129 unq 2 iso 0 dist 7.84813 5.0466 4.4077 6.10584 7.32151 7.01358 6.65878 6.61102 7.6453 8.42289 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 4.82356 8.75242 9.35049 4.84607 5.78814 13.1243 6.9268 4.63862 5.79195 9.64659 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 8.83476 6.45333 9.35049 11.981 5.78814 13.1243 8.19166 4.63862 5.79195 9.64659 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 8.93485 11.2438 8.83628 4.2475 9.31158 14.3203 14.7719 9.70513 4.81837 17.0191 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 8.93485 11.2438 8.83628 4.2475 9.31158 14.3203 8.47833 6.82382 6.43519 11.2748 numMergedOcc 0
13 mol 205 unq 2 iso 0 dist 5.66636 7.47443 8.83628 6.8901 9.31158 14.3203 10.6964 9.70513 4.81837 17.0191 numMergedOcc 0
14 mol 205 unq 3 iso 0 dist 5.66636 7.47443 8.83628 6.8901 9.31158 14.3203 5.47586 6.82382 6.43519 11.2748 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 9.68612 17.6762 9.46274 5.67031 9.06459 14.5108 22.9052 14.085 5.86911 19.5839 numMergedOcc 0
16 mol 214 unq 1 iso 0 dist 9.68612 17.6762 9.46274 5.67031 9.06459 14.5108 20.9423 12.4498 7.89258 17.6894 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 6.61322 9.26732 5.94328 9.07364 8.03012 4.6881 5.9223 5.05766 8.58092 11.1621 numMergedOcc 0
18 mol 258 unq 1 iso 0 dist 6.61322 6.72414 7.91978 9.07364 8.03012 6.80596 5.9223 5.05766 7.40014 11.1621 numMergedOcc 0
19 mol 274 unq 0 iso 0 dist 8.25703 9.65468 8.67957 10.6892 8.12739 7.23876 12.5807 4.66969 9.34051 8.88221 numMergedOcc 0
20 mol 283 unq 0 iso 0 dist 9.35302 7.83784 5.38739 4.44211 9.07995 6.41403 13.8701 8.09099 9.28067 14.8501 numMergedOcc 0
21 mol 285 unq 0 iso 0 dist 5.28731 6.37482 7.08681 4.16039 5.03601 9.237 13.5396 11.2722 7.872 15.1926 numMergedOcc 0
22 mol 285 unq 1 iso 0 dist 5.28731 6.37482 7.08681 4.16039 5.03601 9.237 7.38536 3.57803 6.32984 8.46833 numMergedOcc 0
