0 mol 28 unq 0 iso 0 dist 9.56722 14.9575 9.2146 10.8301 8.53424 16.4255 14.6111 9.64948 15.209 5.42412 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 9.56722 14.9575 9.2146 10.0008 7.08766 16.0765 14.6111 9.64948 15.209 8.09862 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 9.56722 14.9575 9.2146 10.0008 7.08766 16.0765 12.471 10.1805 18.206 8.97167 numMergedOcc 0
3 mol 28 unq 3 iso 0 dist 9.56722 14.9575 9.2146 7.55139 4.82199 13.6412 14.6111 9.64948 15.209 8.89114 numMergedOcc 0
4 mol 28 unq 4 iso 0 dist 9.56722 14.9575 9.2146 7.55139 4.82199 13.6412 12.471 10.1805 18.206 8.8182 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 7.49792 8.03921 8.93807 3.70802 4.46067 5.98227 6.30202 7.90686 12.077 7.01397 numMergedOcc 0
6 mol 62 unq 1 iso 0 dist 6.58981 5.81231 8.93807 3.66673 4.46067 5.98227 10.1974 7.90686 12.077 7.01397 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 8.63792 9.51274 9.57759 8.58059 7.66068 9.50354 9.76901 8.58474 16.1719 9.50939 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 8.39335 13.8821 9.38837 13.0405 8.61143 4.315 11.8447 7.86077 11.2839 7.50229 numMergedOcc 0
9 mol 78 unq 1 iso 0 dist 8.39335 6.6691 9.80913 13.0405 8.61143 9.00868 11.8447 7.86077 10.4541 7.50229 numMergedOcc 0
10 mol 79 unq 0 iso 0 dist 6.29267 5.22146 7.92114 6.02092 4.15789 4.69555 6.00684 4.15002 8.4416 6.64921 numMergedOcc 0
11 mol 79 unq 1 iso 0 dist 6.29267 9.79892 8.18375 6.02092 4.15789 6.49084 6.00684 4.15002 7.79538 6.64921 numMergedOcc 0
12 mol 90 unq 0 iso 0 dist 6.77993 5.41241 7.62463 3.79142 5.24346 5.4118 9.69413 6.65219 12.0429 7.01987 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 5.28746 11.5675 8.20376 9.23405 6.96692 3.68488 8.65743 4.39553 9.51145 9.90506 numMergedOcc 0
14 mol 266 unq 1 iso 0 dist 5.28746 11.5675 8.20376 9.23405 6.96692 3.68488 8.02607 3.94797 10.1964 9.03341 numMergedOcc 0
15 mol 266 unq 2 iso 0 dist 5.28746 11.5675 8.20376 11.313 8.25286 3.14784 10.3532 7.63149 8.9221 6.39822 numMergedOcc 0
16 mol 266 unq 3 iso 0 dist 5.28746 11.5675 8.20376 11.313 8.25286 3.14784 8.65743 4.39553 9.51145 8.61077 numMergedOcc 0
17 mol 266 unq 4 iso 0 dist 5.28746 11.5675 8.20376 13.005 9.9965 5.95721 10.3532 7.63149 8.9221 5.36518 numMergedOcc 0
18 mol 266 unq 5 iso 0 dist 5.28746 11.5675 8.20376 13.005 9.9965 5.95721 8.65743 4.39553 9.51145 9.11585 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 8.15636 6.60353 6.22311 11.4888 6.24487 5.96434 10.6725 5.1451 5.83857 5.44942 numMergedOcc 0
20 mol 287 unq 1 iso 0 dist 8.15636 6.60353 6.22311 11.4888 6.24487 5.96434 14.9495 7.5241 11.0572 8.53689 numMergedOcc 0
21 mol 287 unq 2 iso 0 dist 8.15636 6.60353 6.22311 11.4888 6.24487 5.96434 4.75392 5.15725 5.32839 7.82157 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 8.15636 6.60353 6.22311 11.4888 6.24487 5.96434 10.6725 5.1451 5.83857 5.44942 numMergedOcc 0
23 mol 288 unq 1 iso 0 dist 8.15636 6.60353 6.22311 11.4888 6.24487 5.96434 14.9495 7.5241 11.0572 8.53689 numMergedOcc 0
24 mol 288 unq 2 iso 0 dist 8.15636 6.60353 6.22311 11.4888 6.24487 5.96434 4.75392 5.15725 5.32839 7.82157 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 8.15636 6.60353 6.22311 11.4888 6.24487 5.96434 10.6725 5.1451 5.83857 5.44942 numMergedOcc 0
26 mol 289 unq 1 iso 0 dist 8.15636 6.60353 6.22311 11.4888 6.24487 5.96434 14.9495 7.5241 11.0572 8.53689 numMergedOcc 0
27 mol 289 unq 2 iso 0 dist 8.15636 6.60353 6.22311 11.4888 6.24487 5.96434 4.75392 5.15725 5.32839 7.82157 numMergedOcc 0
