0 mol 17 unq 0 iso 0 dist 6.69539 8.35273 4.0384 5.5951 5.61893 4.64234 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.10233 8.63439 12.9685 9.4718 7.04707 13.411 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 6.34231 9.02073 3.30756 3.88133 8.65313 11.774 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 5.48766 6.0827 8.07308 7.64033 7.92027 13.4169 numMergedOcc 0
4 mol 81 unq 0 iso 0 dist 6.80165 7.94697 5.53904 11.2863 9.89076 9.53663 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 6.24764 7.61514 3.81285 11.6877 9.66549 13.0986 numMergedOcc 0
6 mol 85 unq 1 iso 0 dist 6.24764 8.21116 6.17121 11.6877 9.66549 15.3589 numMergedOcc 0
7 mol 103 unq 0 iso 0 dist 6.95777 7.91691 9.06356 3.97596 9.42444 8.60172 numMergedOcc 0
8 mol 103 unq 1 iso 0 dist 6.95777 7.91691 9.06356 8.25761 9.64736 14.4114 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 8.44588 9.27028 3.7042 16.1275 8.28452 7.08403 numMergedOcc 0
10 mol 120 unq 0 iso 0 dist 8.99783 6.84006 5.90666 3.55317 9.31927 9.18784 numMergedOcc 0
11 mol 120 unq 1 iso 0 dist 7.30776 9.08322 5.90666 4.53716 9.31927 9.18784 numMergedOcc 0
12 mol 120 unq 2 iso 0 dist 8.82602 8.02114 5.90666 6.10284 9.31927 9.18784 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 9.44435 9.3776 5.0146 15.3659 8.30966 13.1651 numMergedOcc 0
14 mol 225 unq 0 iso 0 dist 9.21721 6.15671 6.46348 13.6874 9.58385 13.0486 numMergedOcc 0
15 mol 225 unq 1 iso 0 dist 9.21721 6.15671 6.46348 14.212 6.83539 12.2511 numMergedOcc 0
16 mol 225 unq 2 iso 0 dist 9.21721 6.15671 6.46348 12.0928 6.22747 11.5517 numMergedOcc 0
17 mol 225 unq 3 iso 0 dist 9.21721 6.15671 6.46348 5.21233 9.21404 9.64364 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 8.18538 8.34984 9.06758 7.48068 7.02076 8.71119 numMergedOcc 0
19 mol 264 unq 0 iso 0 dist 6.14231 8.26228 7.71002 11.3988 8.73749 14.2794 numMergedOcc 0
20 mol 278 unq 0 iso 0 dist 5.41035 8.69111 5.40345 7.30732 8.78758 13.2984 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 8.62338 7.96707 3.76412 7.99722 8.19213 8.82649 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 8.62338 7.96707 3.76412 12.9629 5.80664 7.35776 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 8.62338 7.96707 3.76412 7.99722 8.19213 8.82649 numMergedOcc 0
24 mol 288 unq 1 iso 0 dist 8.62338 7.96707 3.76412 12.9629 5.80664 7.35776 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 8.62338 7.96707 3.76412 7.99722 8.19213 8.82649 numMergedOcc 0
26 mol 289 unq 1 iso 0 dist 8.62338 7.96707 3.76412 12.9629 5.80664 7.35776 numMergedOcc 0
