0 mol 4 unq 0 iso 0 dist 5.30385 6.97734 5.39676 5.60295 6.42755 7.15474 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 9.77024 6.97734 12.9411 5.60295 14.9489 7.15474 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 6.8073 7.49794 13.357 13.7393 18.0801 7.1829 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 6.42242 8.26877 13.697 14.2257 18.0984 7.11491 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 5.60663 7.49794 6.34854 13.7393 11.427 7.1829 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 9.22889 7.75543 6.0298 12.0977 14.3527 8.84225 numMergedOcc 0
6 mol 79 unq 1 iso 0 dist 9.22889 7.75543 6.0298 8.15741 9.62311 6.72546 numMergedOcc 0
7 mol 79 unq 2 iso 0 dist 7.99438 6.65972 10.2709 8.69896 15.2256 6.86517 numMergedOcc 0
8 mol 79 unq 3 iso 0 dist 7.99438 6.65972 10.2709 10.3307 12.5801 8.33791 numMergedOcc 0
9 mol 79 unq 4 iso 0 dist 7.99438 4.2253 6.1647 10.3307 12.5801 7.38548 numMergedOcc 0
10 mol 79 unq 5 iso 0 dist 6.64915 6.65972 9.87964 8.69896 13.0098 6.86517 numMergedOcc 0
11 mol 79 unq 6 iso 0 dist 6.64915 6.65972 9.87964 10.3307 9.62311 8.33791 numMergedOcc 0
12 mol 79 unq 7 iso 0 dist 6.64915 4.2253 4.31939 10.3307 9.62311 7.38548 numMergedOcc 0
13 mol 85 unq 0 iso 0 dist 9.18097 7.51319 5.22259 16.5205 11.5179 9.13593 numMergedOcc 0
14 mol 85 unq 1 iso 0 dist 9.18097 8.49887 7.66499 16.5205 11.5179 8.25144 numMergedOcc 0
15 mol 85 unq 2 iso 0 dist 8.83135 9.43839 5.22259 6.53627 11.5179 9.13593 numMergedOcc 0
16 mol 92 unq 0 iso 0 dist 5.74593 4.91714 3.98877 8.27358 5.50508 6.89071 numMergedOcc 0
17 mol 92 unq 1 iso 0 dist 8.02376 4.91714 8.90513 8.27358 11.2428 6.89071 numMergedOcc 0
18 mol 92 unq 2 iso 0 dist 7.31426 6.34669 3.77771 11.6215 10.9574 8.43964 numMergedOcc 0
19 mol 124 unq 0 iso 0 dist 9.18949 8.50362 9.91987 10.1583 16.2607 8.65859 numMergedOcc 0
20 mol 141 unq 0 iso 0 dist 8.46376 8.12558 10.3222 10.9933 16.4417 6.90583 numMergedOcc 0
21 mol 158 unq 0 iso 0 dist 8.07946 9.27714 11.5349 7.46548 12.8463 4.6512 numMergedOcc 0
22 mol 158 unq 1 iso 0 dist 8.07946 9.27714 11.5349 5.97811 13.1523 9.45696 numMergedOcc 0
23 mol 254 unq 0 iso 0 dist 7.28781 9.84028 11.9238 10.6769 16.4757 9.31434 numMergedOcc 0
24 mol 280 unq 0 iso 0 dist 9.38952 7.00616 8.71368 5.87081 6.73712 9.47429 numMergedOcc 0
25 mol 284 unq 0 iso 0 dist 4.87349 8.2236 9.94624 6.50962 7.34931 7.74874 numMergedOcc 0
26 mol 285 unq 0 iso 0 dist 6.46935 4.95596 9.60745 11.9198 16.8864 8.79261 numMergedOcc 0
27 mol 285 unq 1 iso 0 dist 6.46935 6.3508 12.3762 11.9198 16.8864 9.99125 numMergedOcc 0
