0 mol 8 unq 0 iso 0 dist 9.95165 12.915 7.3915 16.9454 7.12263 8.79272 11.959 7.43529 8.96553 11.2076 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.95165 12.915 7.3915 8.95363 5.00267 6.32152 11.959 7.43529 8.96553 10.715 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 9.23617 14.4019 6.92532 6.57527 7.69625 10.3648 21.0095 12.3486 7.20519 17.4261 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 9.23617 14.4019 6.92532 6.57527 7.69625 10.3648 14.2971 5.18512 4.54938 11.6624 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 9.23617 14.4019 6.92532 6.57527 7.69625 10.3648 18.119 9.47529 6.864 13.8921 numMergedOcc 0
5 mol 19 unq 3 iso 0 dist 9.23617 10.38 6.36455 6.57527 7.69625 6.49317 14.2971 5.18512 7.82074 11.6624 numMergedOcc 0
6 mol 19 unq 4 iso 0 dist 8.59114 14.3476 6.92532 8.42839 7.69625 10.3648 19.776 12.3486 7.20519 17.4261 numMergedOcc 0
7 mol 19 unq 5 iso 0 dist 8.59114 14.3476 6.92532 8.42839 7.69625 10.3648 12.8189 5.18512 4.54938 11.6624 numMergedOcc 0
8 mol 19 unq 6 iso 0 dist 8.59114 14.3476 6.92532 8.42839 7.69625 10.3648 14.4543 9.47529 6.864 13.8921 numMergedOcc 0
9 mol 19 unq 7 iso 0 dist 8.59114 12.7 6.36455 8.42839 7.69625 6.49317 12.8189 5.18512 7.82074 11.6624 numMergedOcc 0
10 mol 19 unq 8 iso 0 dist 8.63204 6.57145 6.92532 11.9235 7.69625 10.3648 10.7917 12.3486 7.20519 17.4261 numMergedOcc 0
11 mol 19 unq 9 iso 0 dist 8.63204 6.57145 6.92532 11.9235 7.69625 10.3648 8.18518 5.18512 4.54938 11.6624 numMergedOcc 0
12 mol 19 unq 10 iso 0 dist 8.63204 6.57145 6.92532 11.9235 7.69625 10.3648 12.9091 9.47529 6.864 13.8921 numMergedOcc 0
13 mol 19 unq 11 iso 0 dist 8.63204 6.01189 6.36455 11.9235 7.69625 6.49317 8.18518 5.18512 7.82074 11.6624 numMergedOcc 0
14 mol 24 unq 0 iso 0 dist 4.61828 9.20254 6.60423 13.674 9.38831 6.58998 6.85331 6.00575 6.86014 10.7114 numMergedOcc 0
15 mol 24 unq 1 iso 0 dist 4.61828 9.20254 6.60423 13.674 9.38831 6.58998 10.4452 5.97304 8.86116 6.72502 numMergedOcc 0
16 mol 112 unq 0 iso 0 dist 7.35503 10.0299 7.23962 6.80122 9.74569 6.89221 11.0565 3.98564 9.60462 13.2485 numMergedOcc 0
17 mol 112 unq 1 iso 0 dist 7.35503 11.5698 7.30204 6.80122 9.74569 9.96887 11.0565 3.98564 7.45389 13.2485 numMergedOcc 0
18 mol 112 unq 2 iso 0 dist 8.79543 11.7503 7.23962 7.8709 9.74569 6.89221 11.6825 3.98564 9.60462 13.2485 numMergedOcc 0
19 mol 112 unq 3 iso 0 dist 8.79543 10.886 7.30204 7.8709 9.74569 9.96887 11.6825 3.98564 7.45389 13.2485 numMergedOcc 0
20 mol 112 unq 4 iso 0 dist 6.48223 10.626 7.23962 11.9632 9.74569 6.89221 5.81552 3.98564 9.60462 13.2485 numMergedOcc 0
21 mol 112 unq 5 iso 0 dist 6.48223 5.27363 7.30204 11.9632 9.74569 9.96887 5.81552 3.98564 7.45389 13.2485 numMergedOcc 0
22 mol 115 unq 0 iso 0 dist 8.99731 7.64822 5.72642 4.64486 8.71286 7.21418 7.44784 5.61704 7.30858 10.0289 numMergedOcc 0
23 mol 115 unq 1 iso 0 dist 8.99731 7.64822 5.72642 4.64486 8.71286 7.21418 12.7842 6.4497 5.83991 10.9766 numMergedOcc 0
24 mol 115 unq 2 iso 0 dist 8.99731 7.64822 5.72642 4.64486 8.71286 7.21418 9.56867 7.3094 7.88312 5.74857 numMergedOcc 0
25 mol 119 unq 0 iso 0 dist 8.84146 13.7656 7.77116 16.2159 8.03035 4.91132 10.2589 3.78311 8.73993 8.56342 numMergedOcc 0
26 mol 119 unq 1 iso 0 dist 8.84146 13.7656 7.77116 11.6573 7.6968 6.08167 10.2589 3.78311 8.73993 6.37542 numMergedOcc 0
27 mol 152 unq 0 iso 0 dist 9.19078 7.17016 9.77552 6.79236 6.39031 7.2238 13.9298 9.35627 8.56324 10.4911 numMergedOcc 0
28 mol 152 unq 1 iso 0 dist 9.19078 11.3742 8.28642 6.79236 6.39031 5.59336 13.1463 5.70788 5.87555 8.35555 numMergedOcc 0
29 mol 152 unq 2 iso 0 dist 9.19078 11.3742 8.28642 6.79236 6.39031 5.59336 13.9298 9.35627 6.70283 10.4911 numMergedOcc 0
30 mol 152 unq 3 iso 0 dist 9.19078 11.3742 8.28642 6.79236 6.39031 5.59336 18.3042 11.2078 8.67331 13.0858 numMergedOcc 0
31 mol 156 unq 0 iso 0 dist 9.17868 9.85133 6.2319 7.59931 4.9941 5.71107 14.4092 5.82636 8.34702 7.73169 numMergedOcc 0
32 mol 156 unq 1 iso 0 dist 9.17868 9.85133 6.2319 17.1327 8.06913 10.7023 14.4092 5.82636 8.34702 5.38091 numMergedOcc 0
33 mol 156 unq 2 iso 0 dist 9.17868 15.9362 9.97732 7.59931 4.9941 11.2067 14.4092 5.82636 9.06726 7.73169 numMergedOcc 0
34 mol 156 unq 3 iso 0 dist 9.17868 15.9362 9.97732 17.1327 8.06913 9.00862 14.4092 5.82636 9.06726 5.38091 numMergedOcc 0
35 mol 186 unq 0 iso 0 dist 4.97005 9.14781 8.64409 10.0516 7.55358 4.37002 11.0743 9.97575 9.09754 6.85302 numMergedOcc 0
36 mol 186 unq 1 iso 0 dist 4.97005 9.14781 8.64409 5.57831 7.60991 4.64235 11.0743 9.97575 9.09754 9.98215 numMergedOcc 0
37 mol 227 unq 0 iso 0 dist 9.33735 15.9389 8.38865 10.8608 9.56257 10.5813 17.255 11.0628 7.22101 8.03442 numMergedOcc 0
38 mol 227 unq 1 iso 0 dist 9.33735 15.9389 8.38865 10.8608 9.56257 10.5813 20.5429 12.9587 7.09863 12.2278 numMergedOcc 0
39 mol 227 unq 2 iso 0 dist 9.33735 10.8811 5.4694 10.8608 9.56257 7.22396 17.255 11.0628 8.65997 8.03442 numMergedOcc 0
