0 mol 122 unq 0 iso 0 dist 9.62551 6.80798 10.4526 4.42285 11.9546 4.42563 10.8176 18.9588 12.2092 8.33083 numMergedOcc 0
1 mol 129 unq 0 iso 0 dist 6.65878 7.84813 6.61102 5.56946 8.00624 7.97548 8.63018 5.06265 6.14663 6.29026 numMergedOcc 0
2 mol 133 unq 0 iso 0 dist 6.9268 4.82356 4.63862 4.84607 9.64659 5.78814 6.85651 5.35551 3.75786 8.84018 numMergedOcc 0
3 mol 133 unq 1 iso 0 dist 8.19166 8.83476 4.63862 11.981 9.64659 5.78814 7.03858 5.35551 3.75786 8.84018 numMergedOcc 0
4 mol 147 unq 0 iso 0 dist 5.47265 8.76449 10.0388 6.91778 9.88662 6.73617 6.00651 9.20914 6.99467 9.18866 numMergedOcc 0
5 mol 147 unq 1 iso 0 dist 5.47265 8.36182 9.71714 6.91778 9.88662 9.03544 6.00651 9.20914 4.53687 9.18866 numMergedOcc 0
6 mol 180 unq 0 iso 0 dist 8.4925 7.58661 9.66916 6.54937 13.6604 9.63576 5.43774 5.7627 6.15473 8.44989 numMergedOcc 0
7 mol 205 unq 0 iso 0 dist 9.85777 8.93485 10.5366 4.2475 6.94789 9.31158 10.7582 13.7406 14.8213 8.43584 numMergedOcc 0
8 mol 205 unq 1 iso 0 dist 8.47833 8.93485 6.82382 4.2475 11.2748 9.31158 10.7582 15.4806 14.8213 8.43584 numMergedOcc 0
9 mol 205 unq 2 iso 0 dist 5.05912 8.93485 9.27501 4.2475 6.23932 9.31158 10.7582 8.05429 14.8213 8.43584 numMergedOcc 0
10 mol 205 unq 3 iso 0 dist 5.47586 5.66636 6.82382 6.8901 11.2748 9.31158 13.5379 15.4806 14.8213 8.43584 numMergedOcc 0
11 mol 205 unq 4 iso 0 dist 6.60429 5.66636 9.27501 6.8901 6.23932 9.31158 13.5379 8.05429 14.8213 8.43584 numMergedOcc 0
12 mol 210 unq 0 iso 0 dist 5.70065 9.25184 6.59517 3.84723 6.13878 6.85824 9.97171 5.02037 8.81074 9.67457 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 5.9223 6.61322 5.05766 9.07364 11.1621 8.03012 10.3095 13.2474 8.9947 5.73296 numMergedOcc 0
14 mol 283 unq 0 iso 0 dist 5.90728 9.35302 12.6455 4.44211 10.2452 9.07995 7.90132 8.51629 7.27864 9.53225 numMergedOcc 0
15 mol 285 unq 0 iso 0 dist 7.38536 5.28731 3.57803 4.16039 8.46833 5.03601 12.3495 13.7389 10.6606 8.71213 numMergedOcc 0
16 mol 294 unq 0 iso 0 dist 9.64435 7.48987 10.528 5.57606 14.167 7.56669 10.7501 11.9427 5.71856 9.70907 numMergedOcc 0
17 mol 294 unq 1 iso 0 dist 9.64435 7.48987 10.528 5.57606 14.167 7.56669 5.27236 11.4675 4.99494 6.47832 numMergedOcc 0
