0 mol 61 unq 0 iso 0 dist 9.33829 7.4251 8.6338 8.6006 8.8795 10.0633 numMergedOcc 0
1 mol 61 unq 1 iso 0 dist 9.33829 11.5893 7.31677 8.6006 8.8795 6.30737 numMergedOcc 0
2 mol 67 unq 0 iso 0 dist 7.44693 8.84981 8.62244 4.93428 7.15248 10.5984 numMergedOcc 0
3 mol 67 unq 1 iso 0 dist 7.44693 8.84981 8.62244 9.09433 8.43162 9.67456 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.65565 7.73169 8.98208 9.33353 4.34694 12.456 numMergedOcc 0
5 mol 128 unq 0 iso 0 dist 6.45731 3.97919 8.83811 12.523 8.64054 12.0212 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 8.58727 9.99937 9.56319 8.50536 8.8353 14.3149 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 8.58727 13.3005 9.73038 8.50536 8.8353 17.9749 numMergedOcc 0
8 mol 136 unq 0 iso 0 dist 9.87892 5.12719 7.65792 9.61557 8.41727 4.65485 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 8.57243 11.7201 8.80952 11.0811 9.96635 11.2678 numMergedOcc 0
10 mol 165 unq 0 iso 0 dist 5.81507 9.87383 9.63241 4.49675 5.99596 7.28318 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 7.74764 10.7753 6.36789 6.46011 6.72718 12.6035 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 9.83755 9.83838 7.08083 8.77825 4.36421 6.46773 numMergedOcc 0
13 mol 226 unq 0 iso 0 dist 8.90583 8.63134 9.03261 4.09525 8.74399 9.96567 numMergedOcc 0
14 mol 271 unq 0 iso 0 dist 6.56531 4.7953 6.96986 10.9694 9.50884 12.846 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 6.99084 9.35414 6.96248 10.4062 7.14859 5.66584 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 6.99084 9.35414 6.96248 10.4062 7.14859 5.66584 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 6.99084 9.35414 6.96248 10.4062 7.14859 5.66584 numMergedOcc 0
18 mol 294 unq 0 iso 0 dist 9.00901 16.4748 9.4943 11.231 6.37998 5.71611 numMergedOcc 0
19 mol 294 unq 1 iso 0 dist 9.00901 16.4748 9.4943 14.1974 9.77023 7.88101 numMergedOcc 0
20 mol 294 unq 2 iso 0 dist 8.46132 7.89762 9.4943 6.66087 6.37998 5.71611 numMergedOcc 0
21 mol 294 unq 3 iso 0 dist 8.46132 7.89762 9.4943 13.8417 9.77023 7.88101 numMergedOcc 0
