0 mol 61 unq 0 iso 0 dist 9.7471 4.33424 7.02173 8.19148 5.47405 4.91795 numMergedOcc 0
1 mol 61 unq 1 iso 0 dist 9.7471 4.33424 7.02173 7.64679 9.08027 7.64582 numMergedOcc 0
2 mol 61 unq 2 iso 0 dist 9.7471 4.3676 6.60294 8.19148 5.47405 5.81582 numMergedOcc 0
3 mol 61 unq 3 iso 0 dist 9.7471 4.3676 6.60294 7.64679 9.08027 4.83991 numMergedOcc 0
4 mol 61 unq 4 iso 0 dist 8.92623 12.7474 9.67403 8.40502 5.01022 14.3446 numMergedOcc 0
5 mol 61 unq 5 iso 0 dist 8.92623 10.4703 7.28917 8.40502 5.01022 4.91795 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 8.54374 17.5231 9.78545 8.52022 7.99116 12.2874 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 8.54374 17.5231 9.78545 3.32186 9.19481 17.5543 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 8.54374 15.2861 9.97998 8.52022 7.99116 7.81776 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 8.54374 15.2861 9.97998 3.32186 9.19481 13.9722 numMergedOcc 0
10 mol 103 unq 0 iso 0 dist 8.29525 8.65165 9.81273 4.70237 6.51666 5.71094 numMergedOcc 0
11 mol 103 unq 1 iso 0 dist 7.5724 3.19331 8.9889 4.70237 8.21549 7.19943 numMergedOcc 0
12 mol 103 unq 2 iso 0 dist 7.5724 8.65165 6.67575 4.70237 8.21549 5.71094 numMergedOcc 0
13 mol 183 unq 0 iso 0 dist 6.5372 6.29417 9.86506 12.0439 9.99089 9.58361 numMergedOcc 0
14 mol 183 unq 1 iso 0 dist 6.44683 10.1111 9.86506 11.8273 9.99089 9.58361 numMergedOcc 0
15 mol 196 unq 0 iso 0 dist 7.87748 10.8189 9.48912 6.52595 5.74177 8.34664 numMergedOcc 0
16 mol 196 unq 1 iso 0 dist 4.82797 5.29241 9.48912 5.90771 5.74177 8.34664 numMergedOcc 0
17 mol 197 unq 0 iso 0 dist 8.24588 14.038 6.50727 13.3685 9.12641 6.35266 numMergedOcc 0
18 mol 197 unq 1 iso 0 dist 8.24588 15.6343 7.84826 13.3685 9.12641 10.3477 numMergedOcc 0
19 mol 197 unq 2 iso 0 dist 9.71675 6.68028 6.50727 8.58962 9.12641 6.35266 numMergedOcc 0
20 mol 197 unq 3 iso 0 dist 9.71675 4.58651 7.84826 8.58962 9.12641 10.3477 numMergedOcc 0
21 mol 226 unq 0 iso 0 dist 7.28604 12.9282 8.10096 5.81291 5.01717 7.77366 numMergedOcc 0
22 mol 250 unq 0 iso 0 dist 9.61711 5.34692 8.62074 4.7575 8.40871 6.97343 numMergedOcc 0
23 mol 280 unq 0 iso 0 dist 9.27318 11.8962 7.10723 8.53763 8.66271 5.04137 numMergedOcc 0
24 mol 280 unq 1 iso 0 dist 9.27318 3.86473 6.8664 8.53763 8.66271 6.84622 numMergedOcc 0
25 mol 294 unq 0 iso 0 dist 6.54658 4.1826 9.86356 12.5508 8.11918 15.3832 numMergedOcc 0
