0 mol 20 unq 0 iso 0 dist 8.71628 6.98731 6.4934 9.24986 8.19827 9.49629 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 8.71628 12.0498 6.93199 9.24986 8.19827 5.47538 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 5.97065 7.89671 8.82012 8.4126 7.84204 12.8511 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 5.97065 10.1933 9.16962 8.4126 7.84204 15.962 numMergedOcc 0
4 mol 70 unq 0 iso 0 dist 5.62294 5.33532 9.34122 5.00416 5.48202 6.93285 numMergedOcc 0
5 mol 70 unq 1 iso 0 dist 7.99569 7.6455 9.34122 4.00828 5.48202 6.93285 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 9.40904 9.02503 8.67367 16.8981 9.51981 12.6805 numMergedOcc 0
7 mol 95 unq 1 iso 0 dist 6.47401 7.94986 8.67367 15.3626 9.51981 12.6805 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 8.94447 12.7099 6.81812 4.8668 5.45882 7.84907 numMergedOcc 0
9 mol 113 unq 1 iso 0 dist 8.94447 12.7099 6.81812 8.60367 4.57487 4.11536 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 9.6785 9.04668 6.96442 8.14095 5.96977 4.97363 numMergedOcc 0
11 mol 184 unq 0 iso 0 dist 7.09847 4.59843 9.52936 4.23511 9.46392 7.44296 numMergedOcc 0
12 mol 184 unq 1 iso 0 dist 7.09847 5.66847 9.15417 4.23511 9.46392 5.48752 numMergedOcc 0
13 mol 197 unq 0 iso 0 dist 6.58245 14.8922 8.99696 4.05539 9.6071 16.9912 numMergedOcc 0
14 mol 197 unq 1 iso 0 dist 6.58245 14.8922 8.99696 9.33865 9.77656 11.9685 numMergedOcc 0
15 mol 209 unq 0 iso 0 dist 5.20111 5.35615 9.52027 4.41097 8.62439 5.36295 numMergedOcc 0
16 mol 213 unq 0 iso 0 dist 4.80429 7.18317 6.0965 4.88386 6.8984 4.67313 numMergedOcc 0
17 mol 213 unq 1 iso 0 dist 6.38872 7.17515 8.45368 4.88386 7.77553 9.90805 numMergedOcc 0
18 mol 213 unq 2 iso 0 dist 6.38872 7.18317 9.59129 4.88386 7.77553 4.67313 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 5.66171 12.0404 7.17547 5.27483 8.5244 14.5747 numMergedOcc 0
20 mol 218 unq 1 iso 0 dist 5.66171 7.82717 7.13323 5.27483 8.5244 11.7256 numMergedOcc 0
21 mol 220 unq 0 iso 0 dist 5.13604 4.8419 7.61951 5.11797 9.43419 4.86965 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 6.19297 11.4969 9.90142 4.7142 8.54425 8.71924 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 6.19297 6.33281 5.9216 4.7142 8.54425 4.56594 numMergedOcc 0
24 mol 238 unq 2 iso 0 dist 9.3099 11.1632 9.90142 15.4987 8.54425 8.71924 numMergedOcc 0
25 mol 238 unq 3 iso 0 dist 9.3099 11.0996 5.9216 15.4987 8.54425 4.56594 numMergedOcc 0
26 mol 264 unq 0 iso 0 dist 8.75957 14.447 9.5784 17.1788 8.56867 11.147 numMergedOcc 0
27 mol 264 unq 1 iso 0 dist 8.75957 14.447 9.5784 15.0574 6.29872 10.0018 numMergedOcc 0
28 mol 274 unq 0 iso 0 dist 8.38395 6.45522 9.19234 3.47588 9.85661 4.60007 numMergedOcc 0
