0 mol 117 unq 0 iso 0 dist 8.76613 6.29379 7.20326 5.45718 7.70232 9.79891 10.1626 4.46691 11.0017 6.5788 numMergedOcc 0
1 mol 117 unq 1 iso 0 dist 8.76613 6.29379 7.20326 6.25846 7.4671 9.97229 10.1626 4.46691 11.0017 6.2771 numMergedOcc 0
2 mol 181 unq 0 iso 0 dist 9.25528 14.3955 6.94688 15.4597 8.90963 4.43678 18.3848 11.618 11.7261 9.20617 numMergedOcc 0
3 mol 181 unq 1 iso 0 dist 9.25528 15.6271 6.71012 15.4597 8.90963 6.03415 18.3848 11.618 7.61421 9.20617 numMergedOcc 0
4 mol 182 unq 0 iso 0 dist 6.31492 5.37421 6.73313 11.1247 7.09394 10.7622 11.5665 6.45169 8.98501 9.98182 numMergedOcc 0
5 mol 182 unq 1 iso 0 dist 6.31492 5.37421 6.73313 11.1247 7.09394 10.7622 11.2241 6.1548 12.8588 9.02127 numMergedOcc 0
6 mol 182 unq 2 iso 0 dist 7.8621 13.0784 6.73313 5.77163 7.09394 10.7622 12.8805 6.45169 8.98501 9.98182 numMergedOcc 0
7 mol 182 unq 3 iso 0 dist 7.8621 13.0784 6.73313 5.77163 7.09394 10.7622 7.01577 6.1548 12.8588 9.02127 numMergedOcc 0
8 mol 205 unq 0 iso 0 dist 7.36642 7.13867 9.19704 10.098 6.03688 14.6029 12.0992 6.49049 14.9615 5.59832 numMergedOcc 0
9 mol 213 unq 0 iso 0 dist 6.82185 10.693 6.0965 10.6201 7.37798 6.17282 7.86605 4.71943 10.4143 9.34602 numMergedOcc 0
10 mol 213 unq 1 iso 0 dist 6.82185 10.693 6.0965 5.50169 7.73322 10.5013 10.3304 4.67313 6.8984 8.59946 numMergedOcc 0
11 mol 213 unq 2 iso 0 dist 6.82185 12.9129 9.59129 10.6201 7.37798 12.1116 7.86605 4.71943 14.2472 9.34602 numMergedOcc 0
12 mol 213 unq 3 iso 0 dist 6.82185 12.9129 9.59129 5.50169 7.73322 9.93085 10.3304 4.67313 7.77553 8.59946 numMergedOcc 0
13 mol 249 unq 0 iso 0 dist 6.42827 5.63238 8.83735 5.74889 5.48118 10.639 6.32658 10.3504 10.5843 8.76518 numMergedOcc 0
14 mol 284 unq 0 iso 0 dist 7.18433 6.04378 4.86729 11.2038 6.78191 6.76453 18.218 12.4957 12.6969 7.74874 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 7.28096 9.67343 7.04472 12.4113 6.89451 4.481 10.1135 4.21609 9.53713 7.99204 numMergedOcc 0
16 mol 287 unq 1 iso 0 dist 7.28096 6.32031 6.4778 12.4113 6.89451 12.237 10.1135 4.21609 9.97749 7.99204 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 7.28096 9.67343 7.04472 12.4113 6.89451 4.481 10.1135 4.21609 9.53713 7.99204 numMergedOcc 0
18 mol 288 unq 1 iso 0 dist 7.28096 6.32031 6.4778 12.4113 6.89451 12.237 10.1135 4.21609 9.97749 7.99204 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 7.28096 9.67343 7.04472 12.4113 6.89451 4.481 10.1135 4.21609 9.53713 7.99204 numMergedOcc 0
20 mol 289 unq 1 iso 0 dist 7.28096 6.32031 6.4778 12.4113 6.89451 12.237 10.1135 4.21609 9.97749 7.99204 numMergedOcc 0
