0 mol 16 unq 0 iso 0 dist 5.59641 6.06435 7.72142 5.28404 8.47315 5.40044 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 7.6585 4.9049 8.23618 11.6619 6.80741 10.1759 numMergedOcc 0
2 mol 56 unq 1 iso 0 dist 8.79531 5.78106 8.23618 6.39417 6.80741 10.1759 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 9.19647 5.98329 6.85094 10.5573 5.92705 7.15161 numMergedOcc 0
4 mol 101 unq 0 iso 0 dist 5.58941 5.23253 5.51185 5.81947 8.77773 9.11989 numMergedOcc 0
5 mol 102 unq 0 iso 0 dist 6.00241 7.93639 9.61113 13.0204 9.01767 13.9809 numMergedOcc 0
6 mol 102 unq 1 iso 0 dist 6.00241 9.47676 7.73836 13.0204 9.01767 5.09542 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 5.98822 5.4348 5.24519 7.16387 7.70533 5.34484 numMergedOcc 0
8 mol 232 unq 0 iso 0 dist 7.38809 6.24164 7.33708 9.36045 8.68464 11.4953 numMergedOcc 0
9 mol 232 unq 1 iso 0 dist 7.38809 6.92292 4.46314 9.36045 8.68464 5.20266 numMergedOcc 0
10 mol 239 unq 0 iso 0 dist 7.19903 4.828 8.78008 10.7361 9.37996 10.9742 numMergedOcc 0
11 mol 251 unq 0 iso 0 dist 5.84458 6.9737 8.65547 4.80531 9.82043 10.0672 numMergedOcc 0
12 mol 251 unq 1 iso 0 dist 8.96097 6.23286 8.65547 5.60154 9.82043 10.0672 numMergedOcc 0
13 mol 252 unq 0 iso 0 dist 9.19372 11.3721 8.04265 11.7432 9.73021 14.8036 numMergedOcc 0
14 mol 252 unq 1 iso 0 dist 9.19372 5.5062 9.42193 11.7432 9.73021 14.864 numMergedOcc 0
15 mol 257 unq 0 iso 0 dist 9.77089 10.1158 5.65496 5.22536 4.97263 6.75122 numMergedOcc 0
16 mol 257 unq 1 iso 0 dist 9.77089 10.1158 5.65496 10.3792 5.36776 5.99362 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 7.71756 7.75766 8.36043 5.58306 9.81815 8.13367 numMergedOcc 0
18 mol 274 unq 1 iso 0 dist 8.54272 5.79473 7.24089 10.1263 6.00877 5.56999 numMergedOcc 0
19 mol 274 unq 2 iso 0 dist 8.54272 3.92316 9.29005 10.1263 6.00877 10.2696 numMergedOcc 0
20 mol 274 unq 3 iso 0 dist 9.43429 3.92316 8.16746 10.1263 8.66451 10.2696 numMergedOcc 0
