0 mol 13 unq 0 iso 0 dist 6.02651 9.65051 10.4833 14.6855 15.6834 9.57675 numMergedOcc 0
1 mol 13 unq 1 iso 0 dist 6.02651 9.65051 10.4833 8.31354 12.0686 8.84159 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 8.25499 9.40183 4.03124 6.44625 8.48847 7.21054 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 9.25638 9.67641 10.4188 12.9715 15.4437 6.58279 numMergedOcc 0
4 mol 67 unq 1 iso 0 dist 8.01856 9.67641 6.56501 12.9715 11.1591 6.58279 numMergedOcc 0
5 mol 71 unq 0 iso 0 dist 7.12853 8.72533 6.64442 11.3465 13.4127 8.44181 numMergedOcc 0
6 mol 71 unq 1 iso 0 dist 6.14513 9.14345 6.64442 11.7544 13.4127 8.44181 numMergedOcc 0
7 mol 71 unq 2 iso 0 dist 7.4392 9.14345 11.496 11.7544 17.6028 8.44181 numMergedOcc 0
8 mol 81 unq 0 iso 0 dist 6.9055 9.87911 5.73842 5.09563 5.61263 6.73819 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 7.88143 6.04768 12.9271 6.14241 9.80586 4.96613 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 6.62952 6.04768 12.2431 6.14241 12.3071 4.96613 numMergedOcc 0
11 mol 98 unq 2 iso 0 dist 4.3521 9.40173 12.2431 10.8152 12.3071 4.96613 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 9.02712 9.93309 15.0618 4.83663 9.93819 5.80404 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 6.48475 5.24709 4.2484 5.89191 9.47845 8.44423 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 6.48475 5.24709 4.2484 6.08258 8.89232 6.16169 numMergedOcc 0
15 mol 141 unq 0 iso 0 dist 8.5614 7.38183 9.5453 13.1656 13.8368 7.35385 numMergedOcc 0
16 mol 156 unq 0 iso 0 dist 5.50879 6.00295 6.65278 4.67196 10.0614 8.60394 numMergedOcc 0
17 mol 156 unq 1 iso 0 dist 6.69157 6.10069 7.27063 4.91642 10.5776 7.70894 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 7.6409 8.09667 4.93748 4.29134 6.94326 9.53805 numMergedOcc 0
19 mol 226 unq 0 iso 0 dist 8.24741 6.82883 4.66376 16.1524 11.6353 9.61639 numMergedOcc 0
20 mol 226 unq 1 iso 0 dist 5.07958 8.22518 4.66376 15.429 11.6353 9.61639 numMergedOcc 0
21 mol 226 unq 2 iso 0 dist 6.19519 6.02803 4.66376 5.77365 11.6353 9.61639 numMergedOcc 0
22 mol 232 unq 0 iso 0 dist 6.72105 6.71099 5.0625 6.26321 10.1522 9.92671 numMergedOcc 0
23 mol 232 unq 1 iso 0 dist 7.96569 6.71099 4.86592 6.26321 8.50304 9.92671 numMergedOcc 0
24 mol 233 unq 0 iso 0 dist 9.53639 8.76329 6.33637 10.9953 15.4515 9.82733 numMergedOcc 0
25 mol 243 unq 0 iso 0 dist 7.2154 7.74534 3.89742 4.96479 7.20531 5.98438 numMergedOcc 0
